data_51921 ####################### # Entry information # ####################### save_entry_information_1 _Entry.Sf_category entry_information _Entry.Sf_framecode entry_information_1 _Entry.ID 51921 _Entry.Title ; NT8-13 bound enNTS1DM4 with Galpha-iq & PIP2 ; _Entry.Type macromolecule _Entry.Version_type original _Entry.Submission_date 2023-04-17 _Entry.Accession_date 2023-04-17 _Entry.Last_release_date 2023-04-18 _Entry.Original_release_date 2023-04-18 _Entry.Origination author _Entry.Format_name . _Entry.NMR_STAR_version 3.2.14.0 _Entry.NMR_STAR_dict_location . _Entry.Original_NMR_STAR_version 3.1 _Entry.Experimental_method NMR _Entry.Experimental_method_subtype solution _Entry.Source_data_format . _Entry.Source_data_format_version . _Entry.Generated_software_name . _Entry.Generated_software_version . _Entry.Generated_software_ID . _Entry.Generated_software_label . _Entry.Generated_date . _Entry.DOI . _Entry.UUID . _Entry.Related_coordinate_file_name . _Entry.Details . _Entry.BMRB_internal_directory_name . loop_ _Entry_author.Ordinal _Entry_author.Given_name _Entry_author.Family_name _Entry_author.First_initial _Entry_author.Middle_initials _Entry_author.Family_title _Entry_author.ORCID _Entry_author.Entry_ID 1 Fabian Bumbak . . . 0000-0003-2739-8197 51921 2 Joshua Ziarek . J. . 0000-0002-3740-9999 51921 3 Scott Robson . A. . . 51921 4 Hongwei Wu . . . . 51921 stop_ loop_ _Entry_src.ID _Entry_src.Project_name _Entry_src.Organization_full_name _Entry_src.Organization_initials _Entry_src.Entry_ID 1 . 'Indiana University' . 51921 stop_ loop_ _Data_set.Type _Data_set.Count _Data_set.Entry_ID assigned_chemical_shifts 1 51921 stop_ loop_ _Datum.Type _Datum.Count _Datum.Entry_ID '13C chemical shifts' 11 51921 '1H chemical shifts' 33 51921 stop_ loop_ _Release.Release_number _Release.Format_type _Release.Format_version _Release.Date _Release.Submission_date _Release.Type _Release.Author _Release.Detail _Release.Entry_ID 2 . . 2023-06-17 2023-04-17 update BMRB 'update entry citation' 51921 1 . . 2023-05-04 2023-04-17 original author 'original release' 51921 stop_ loop_ _Related_entries.Database_name _Related_entries.Database_accession_code _Related_entries.Relationship _Related_entries.Entry_ID BMRB 51728 'Apo-state enNTS1DM4' 51921 BMRB 51735 'NT8-13 bound enNTS1DM4' 51921 BMRB 51736 'SR142948A bound enNTS1DM4' 51921 BMRB 51737 'ML314 bound enNTS1DM4' 51921 BMRB 51738 'NT8-13 & ML314 bound enNTS1DM4' 51921 BMRB 51908 'Apo-state enNTS1DM4 with PIP2' 51921 BMRB 51909 'NT8-13 bound enNTS1DM4 with PIP2' 51921 BMRB 51910 'ML314 bound enNTS1DM4 with PIP2' 51921 BMRB 51911 'NT8-13 & ML314 bound enNTS1DM4 with PIP2' 51921 BMRB 51914 'NT8-13 bound enNTS1DM4 with beta-Arrestin1-3A' 51921 BMRB 51915 'NT8-13 bound enNTS1DM4 with beta-Arrestin1-3A & PIP2' 51921 BMRB 51916 'ML314 bound enNTS1DM4 with beta-Arrestin1-3A & PIP2' 51921 BMRB 51917 'NT8-13 & ML314 bound enNTS1DM4 with beta-Arrestin-1-3A & PIP2' 51921 BMRB 51927 'NT8-13 & ML314 bound enNTS1DM4 with Gaiq & PIP2' 51921 stop_ save_ ############### # Citations # ############### save_citations_1 _Citation.Sf_category citations _Citation.Sf_framecode citations_1 _Citation.Entry_ID 51921 _Citation.ID 1 _Citation.Name . _Citation.Class 'entry citation' _Citation.CAS_abstract_code . _Citation.MEDLINE_UI_code . _Citation.PubMed_ID 37286565 _Citation.DOI . _Citation.Full_citation . _Citation.Title ; Stabilization of pre-existing neurotensin receptor conformational states by b-arrestin-1 and the biased allosteric modulator ML314 ; _Citation.Status published _Citation.Type journal _Citation.Journal_abbrev 'Nat. commun.' _Citation.Journal_name_full 'Nature communications' _Citation.Journal_volume 14 _Citation.Journal_issue 1 _Citation.Journal_ASTM . _Citation.Journal_ISSN 2041-1723 _Citation.Journal_CSD . _Citation.Book_title . _Citation.Book_chapter_title . _Citation.Book_volume . _Citation.Book_series . _Citation.Book_publisher . _Citation.Book_publisher_city . _Citation.Book_ISBN . _Citation.Conference_title . _Citation.Conference_site . _Citation.Conference_state_province . _Citation.Conference_country . _Citation.Conference_start_date . _Citation.Conference_end_date . _Citation.Conference_abstract_number . _Citation.Thesis_institution . _Citation.Thesis_institution_city . _Citation.Thesis_institution_country . _Citation.WWW_URL . _Citation.Page_first 3328 _Citation.Page_last 3328 _Citation.Year 2023 _Citation.Details . loop_ _Citation_author.Ordinal _Citation_author.Given_name _Citation_author.Family_name _Citation_author.First_initial _Citation_author.Middle_initials _Citation_author.Family_title _Citation_author.ORCID _Citation_author.Entry_ID _Citation_author.Citation_ID 1 Fabian Bumbak . . . . 51921 1 2 James Bower . B. . . 51921 1 3 Skylar Zemmer . C. . . 51921 1 4 Asuka Inoue . . . . 51921 1 5 Miquel Pons . . . . 51921 1 6 'Juan Carlos' Paniagua . . . . 51921 1 7 Fei Yan . . . . 51921 1 8 James Ford . . . . 51921 1 9 Hongwei Wu . . . . 51921 1 10 Scott Robson . A. . . 51921 1 11 Ross Bathgate . A.D. . . 51921 1 12 Daniel Scott . J. . . 51921 1 13 Paul Gooley . R. . . 51921 1 14 Joshua Ziarek . J. . . 51921 1 stop_ loop_ _Citation_keyword.Keyword _Citation_keyword.Entry_ID _Citation_keyword.Citation_ID 'G protein-coupled receptors (GPCRs)' 51921 1 NMR 51921 1 'PIF motif' 51921 1 'Phosphatidylinositol-4,5-bisphosphate (PIP2)' 51921 1 'allosteric modulator' 51921 1 'conformational selection' 51921 1 methionine 51921 1 stop_ save_ ############################################# # Molecular system (assembly) description # ############################################# save_assembly_1 _Assembly.Sf_category assembly _Assembly.Sf_framecode assembly_1 _Assembly.Entry_ID 51921 _Assembly.ID 1 _Assembly.Name 'NT8-13 bound enNTS1DM4 with Gaiq & PIP2' _Assembly.BMRB_code . _Assembly.Number_of_components 8 _Assembly.Organic_ligands 1 _Assembly.Metal_ions 0 _Assembly.Non_standard_bonds no _Assembly.Ambiguous_conformational_states yes _Assembly.Ambiguous_chem_comp_sites . _Assembly.Molecules_in_chemical_exchange yes _Assembly.Paramagnetic no _Assembly.Thiol_state . _Assembly.Molecular_mass . _Assembly.Enzyme_commission_number . _Assembly.Details '1 ligand for NT8-13; 1 transducer protein Galpha-iq; 1 or more PIP2 molecules' _Assembly.DB_query_date . _Assembly.DB_query_revised_last_date . loop_ _Entity_assembly.ID _Entity_assembly.Entity_assembly_name _Entity_assembly.Entity_ID _Entity_assembly.Entity_label _Entity_assembly.Asym_ID _Entity_assembly.PDB_chain_ID _Entity_assembly.Experimental_data_reported _Entity_assembly.Physical_state _Entity_assembly.Conformational_isomer _Entity_assembly.Chemical_exchange_state _Entity_assembly.Magnetic_equivalence_group_code _Entity_assembly.Role _Entity_assembly.Details _Entity_assembly.Entry_ID _Entity_assembly.Assembly_ID 1 'enNTS1DM4, conformer A' 1 $entity_1 . . yes native no no . . . 51921 1 2 'enNTS1DM4, conformer B' 1 $entity_1 . . yes native no no . . . 51921 1 3 'enNTS1DM4, conformer C' 1 $entity_1 . . yes native no no . . . 51921 1 4 'enNTS1DM4, conformer D' 1 $entity_1 . . yes native no no . . . 51921 1 5 'enNTS1DM4, conformer E' 1 $entity_1 . . yes native no no . . . 51921 1 6 NT8-13 2 $entity_2 . . no native no no . . . 51921 1 7 Gaiq 3 $entity_3 . . no native no no . . . 51921 1 8 PIP2 4 $entity_4 . . no native no no . . . 51921 1 stop_ loop_ _Bond.ID _Bond.Type _Bond.Value_order _Bond.Assembly_atom_ID_1 _Bond.Entity_assembly_ID_1 _Bond.Entity_assembly_name_1 _Bond.Entity_ID_1 _Bond.Comp_ID_1 _Bond.Comp_index_ID_1 _Bond.Seq_ID_1 _Bond.Atom_ID_1 _Bond.Assembly_atom_ID_2 _Bond.Entity_assembly_ID_2 _Bond.Entity_assembly_name_2 _Bond.Entity_ID_2 _Bond.Comp_ID_2 _Bond.Comp_index_ID_2 _Bond.Seq_ID_2 _Bond.Atom_ID_2 _Bond.Auth_entity_assembly_ID_1 _Bond.Auth_entity_assembly_name_1 _Bond.Auth_asym_ID_1 _Bond.Auth_seq_ID_1 _Bond.Auth_comp_ID_1 _Bond.Auth_atom_ID_1 _Bond.Auth_entity_assembly_ID_2 _Bond.Auth_entity_assembly_name_2 _Bond.Auth_asym_ID_2 _Bond.Auth_seq_ID_2 _Bond.Auth_comp_ID_2 _Bond.Auth_atom_ID_2 _Bond.Entry_ID _Bond.Assembly_ID 1 disulfide single . 1 . 1 CYS 104 104 SG . 1 . 1 CYS 187 187 SG . . . 142 CYS SG . . . 225 CYS SG 51921 1 stop_ save_ #################################### # Biological polymers and ligands # #################################### save_entity_1 _Entity.Sf_category entity _Entity.Sf_framecode entity_1 _Entity.Entry_ID 51921 _Entity.ID 1 _Entity.BMRB_code . _Entity.Name entity_1 _Entity.Type polymer _Entity.Polymer_common_type . _Entity.Polymer_type polypeptide(L) _Entity.Polymer_type_details . _Entity.Polymer_strand_ID . _Entity.Polymer_seq_one_letter_code_can . _Entity.Polymer_seq_one_letter_code ; GPGSTSESDTAGPNSDLDVN TDIYSKVLVTAIYLALFVVG TVGNGVTLFTLARKKSLQSL QSRVDYYLGSLALSSLLILL FALPVDVYNFIWVHHPWAFG DAGCKGYYFLREACTYATAL NVVSLSVERYLAICHPFKAK TLLSRSRTKKFISAIWLASA LLSLPMLFTMGLQNLSGDGT HPGGLVCTPIVDTATLRVVI QLNTFMSFLFPMLVASILNT VIARRLTVLVHQAAEQARVS TVGTHNGLEHSTFNVTIEPG RVQALRRGVLVLRAVVIAFV VCWLPYHVRRLMFVYISDEQ WTTALFDFYHYFYMLSNALV YVSAAINPILYNLVSANFRQ VFLSTLASLSPGWRHRRKKR PTFSRKPNSVSSNHAFSTAS GLNDIFEAQKIEWHEGSGLE VLFQ ; _Entity.Target_identifier . _Entity.Polymer_author_defined_seq . _Entity.Polymer_author_seq_details ; Thermostabilized rat neurotensin receptor 1 variant starts with the first T (T43) and ends with T416 (truncated). The protein contains a C-terminal Avi-tag and remnants of a 3C-protease cleavage tag (ASGLNDIFEAQKIEWHEGSGLEVLFQ). The N-terminal four residues (GPGS) are remnants of a 3C-protease cleavage site and a short, flexible GS sequence. ; _Entity.Ambiguous_conformational_states yes _Entity.Ambiguous_chem_comp_sites no _Entity.Nstd_monomer no _Entity.Nstd_chirality no _Entity.Nstd_linkage no _Entity.Nonpolymer_comp_ID . _Entity.Nonpolymer_comp_label . _Entity.Number_of_monomers 404 _Entity.Number_of_nonpolymer_components . _Entity.Paramagnetic no _Entity.Thiol_state 'free and disulfide bound' _Entity.Src_method . _Entity.Parent_entity_ID 1 _Entity.Fragment . _Entity.Mutation ; S83G, A86L, T101R, H103D, H105Y, D113S, L119F, M121L, E124D, L125V, R143K, D150E, A161V, M181L, A201S, R213L, V234L, K235R, V240L, I253A, N262R, K263R, M267L, G275A, C278S, M293L, H305R, C332V, F342A, T354S, F358V, S362A, C386S, C388S, M408V. ; _Entity.EC_number . _Entity.Calc_isoelectric_point . _Entity.Formula_weight 44889.10 _Entity.Formula_weight_exptl . _Entity.Formula_weight_exptl_meth . _Entity.Details . _Entity.DB_query_date . _Entity.DB_query_revised_last_date . loop_ _Entity_comp_index.ID _Entity_comp_index.Auth_seq_ID _Entity_comp_index.Comp_ID _Entity_comp_index.Comp_label _Entity_comp_index.Entry_ID _Entity_comp_index.Entity_ID 1 39 GLY . 51921 1 2 40 PRO . 51921 1 3 41 GLY . 51921 1 4 42 SER . 51921 1 5 43 THR . 51921 1 6 44 SER . 51921 1 7 45 GLU . 51921 1 8 46 SER . 51921 1 9 47 ASP . 51921 1 10 48 THR . 51921 1 11 49 ALA . 51921 1 12 50 GLY . 51921 1 13 51 PRO . 51921 1 14 52 ASN . 51921 1 15 53 SER . 51921 1 16 54 ASP . 51921 1 17 55 LEU . 51921 1 18 56 ASP . 51921 1 19 57 VAL . 51921 1 20 58 ASN . 51921 1 21 59 THR . 51921 1 22 60 ASP . 51921 1 23 61 ILE . 51921 1 24 62 TYR . 51921 1 25 63 SER . 51921 1 26 64 LYS . 51921 1 27 65 VAL . 51921 1 28 66 LEU . 51921 1 29 67 VAL . 51921 1 30 68 THR . 51921 1 31 69 ALA . 51921 1 32 70 ILE . 51921 1 33 71 TYR . 51921 1 34 72 LEU . 51921 1 35 73 ALA . 51921 1 36 74 LEU . 51921 1 37 75 PHE . 51921 1 38 76 VAL . 51921 1 39 77 VAL . 51921 1 40 78 GLY . 51921 1 41 79 THR . 51921 1 42 80 VAL . 51921 1 43 81 GLY . 51921 1 44 82 ASN . 51921 1 45 83 GLY . 51921 1 46 84 VAL . 51921 1 47 85 THR . 51921 1 48 86 LEU . 51921 1 49 87 PHE . 51921 1 50 88 THR . 51921 1 51 89 LEU . 51921 1 52 90 ALA . 51921 1 53 91 ARG . 51921 1 54 92 LYS . 51921 1 55 93 LYS . 51921 1 56 94 SER . 51921 1 57 95 LEU . 51921 1 58 96 GLN . 51921 1 59 97 SER . 51921 1 60 98 LEU . 51921 1 61 99 GLN . 51921 1 62 100 SER . 51921 1 63 101 ARG . 51921 1 64 102 VAL . 51921 1 65 103 ASP . 51921 1 66 104 TYR . 51921 1 67 105 TYR . 51921 1 68 106 LEU . 51921 1 69 107 GLY . 51921 1 70 108 SER . 51921 1 71 109 LEU . 51921 1 72 110 ALA . 51921 1 73 111 LEU . 51921 1 74 112 SER . 51921 1 75 113 SER . 51921 1 76 114 LEU . 51921 1 77 115 LEU . 51921 1 78 116 ILE . 51921 1 79 117 LEU . 51921 1 80 118 LEU . 51921 1 81 119 PHE . 51921 1 82 120 ALA . 51921 1 83 121 LEU . 51921 1 84 122 PRO . 51921 1 85 123 VAL . 51921 1 86 124 ASP . 51921 1 87 125 VAL . 51921 1 88 126 TYR . 51921 1 89 127 ASN . 51921 1 90 128 PHE . 51921 1 91 129 ILE . 51921 1 92 130 TRP . 51921 1 93 131 VAL . 51921 1 94 132 HIS . 51921 1 95 133 HIS . 51921 1 96 134 PRO . 51921 1 97 135 TRP . 51921 1 98 136 ALA . 51921 1 99 137 PHE . 51921 1 100 138 GLY . 51921 1 101 139 ASP . 51921 1 102 140 ALA . 51921 1 103 141 GLY . 51921 1 104 142 CYS . 51921 1 105 143 LYS . 51921 1 106 144 GLY . 51921 1 107 145 TYR . 51921 1 108 146 TYR . 51921 1 109 147 PHE . 51921 1 110 148 LEU . 51921 1 111 149 ARG . 51921 1 112 150 GLU . 51921 1 113 151 ALA . 51921 1 114 152 CYS . 51921 1 115 153 THR . 51921 1 116 154 TYR . 51921 1 117 155 ALA . 51921 1 118 156 THR . 51921 1 119 157 ALA . 51921 1 120 158 LEU . 51921 1 121 159 ASN . 51921 1 122 160 VAL . 51921 1 123 161 VAL . 51921 1 124 162 SER . 51921 1 125 163 LEU . 51921 1 126 164 SER . 51921 1 127 165 VAL . 51921 1 128 166 GLU . 51921 1 129 167 ARG . 51921 1 130 168 TYR . 51921 1 131 169 LEU . 51921 1 132 170 ALA . 51921 1 133 171 ILE . 51921 1 134 172 CYS . 51921 1 135 173 HIS . 51921 1 136 174 PRO . 51921 1 137 175 PHE . 51921 1 138 176 LYS . 51921 1 139 177 ALA . 51921 1 140 178 LYS . 51921 1 141 179 THR . 51921 1 142 180 LEU . 51921 1 143 181 LEU . 51921 1 144 182 SER . 51921 1 145 183 ARG . 51921 1 146 184 SER . 51921 1 147 185 ARG . 51921 1 148 186 THR . 51921 1 149 187 LYS . 51921 1 150 188 LYS . 51921 1 151 189 PHE . 51921 1 152 190 ILE . 51921 1 153 191 SER . 51921 1 154 192 ALA . 51921 1 155 193 ILE . 51921 1 156 194 TRP . 51921 1 157 195 LEU . 51921 1 158 196 ALA . 51921 1 159 197 SER . 51921 1 160 198 ALA . 51921 1 161 199 LEU . 51921 1 162 200 LEU . 51921 1 163 201 SER . 51921 1 164 202 LEU . 51921 1 165 203 PRO . 51921 1 166 204 MET . 51921 1 167 205 LEU . 51921 1 168 206 PHE . 51921 1 169 207 THR . 51921 1 170 208 MET . 51921 1 171 209 GLY . 51921 1 172 210 LEU . 51921 1 173 211 GLN . 51921 1 174 212 ASN . 51921 1 175 213 LEU . 51921 1 176 214 SER . 51921 1 177 215 GLY . 51921 1 178 216 ASP . 51921 1 179 217 GLY . 51921 1 180 218 THR . 51921 1 181 219 HIS . 51921 1 182 220 PRO . 51921 1 183 221 GLY . 51921 1 184 222 GLY . 51921 1 185 223 LEU . 51921 1 186 224 VAL . 51921 1 187 225 CYS . 51921 1 188 226 THR . 51921 1 189 227 PRO . 51921 1 190 228 ILE . 51921 1 191 229 VAL . 51921 1 192 230 ASP . 51921 1 193 231 THR . 51921 1 194 232 ALA . 51921 1 195 233 THR . 51921 1 196 234 LEU . 51921 1 197 235 ARG . 51921 1 198 236 VAL . 51921 1 199 237 VAL . 51921 1 200 238 ILE . 51921 1 201 239 GLN . 51921 1 202 240 LEU . 51921 1 203 241 ASN . 51921 1 204 242 THR . 51921 1 205 243 PHE . 51921 1 206 244 MET . 51921 1 207 245 SER . 51921 1 208 246 PHE . 51921 1 209 247 LEU . 51921 1 210 248 PHE . 51921 1 211 249 PRO . 51921 1 212 250 MET . 51921 1 213 251 LEU . 51921 1 214 252 VAL . 51921 1 215 253 ALA . 51921 1 216 254 SER . 51921 1 217 255 ILE . 51921 1 218 256 LEU . 51921 1 219 257 ASN . 51921 1 220 258 THR . 51921 1 221 259 VAL . 51921 1 222 260 ILE . 51921 1 223 261 ALA . 51921 1 224 262 ARG . 51921 1 225 263 ARG . 51921 1 226 264 LEU . 51921 1 227 265 THR . 51921 1 228 266 VAL . 51921 1 229 267 LEU . 51921 1 230 268 VAL . 51921 1 231 269 HIS . 51921 1 232 270 GLN . 51921 1 233 271 ALA . 51921 1 234 272 ALA . 51921 1 235 273 GLU . 51921 1 236 274 GLN . 51921 1 237 275 ALA . 51921 1 238 276 ARG . 51921 1 239 277 VAL . 51921 1 240 278 SER . 51921 1 241 279 THR . 51921 1 242 280 VAL . 51921 1 243 281 GLY . 51921 1 244 282 THR . 51921 1 245 283 HIS . 51921 1 246 284 ASN . 51921 1 247 285 GLY . 51921 1 248 286 LEU . 51921 1 249 287 GLU . 51921 1 250 288 HIS . 51921 1 251 289 SER . 51921 1 252 290 THR . 51921 1 253 291 PHE . 51921 1 254 292 ASN . 51921 1 255 293 VAL . 51921 1 256 294 THR . 51921 1 257 295 ILE . 51921 1 258 296 GLU . 51921 1 259 297 PRO . 51921 1 260 298 GLY . 51921 1 261 299 ARG . 51921 1 262 300 VAL . 51921 1 263 301 GLN . 51921 1 264 302 ALA . 51921 1 265 303 LEU . 51921 1 266 304 ARG . 51921 1 267 305 ARG . 51921 1 268 306 GLY . 51921 1 269 307 VAL . 51921 1 270 308 LEU . 51921 1 271 309 VAL . 51921 1 272 310 LEU . 51921 1 273 311 ARG . 51921 1 274 312 ALA . 51921 1 275 313 VAL . 51921 1 276 314 VAL . 51921 1 277 315 ILE . 51921 1 278 316 ALA . 51921 1 279 317 PHE . 51921 1 280 318 VAL . 51921 1 281 319 VAL . 51921 1 282 320 CYS . 51921 1 283 321 TRP . 51921 1 284 322 LEU . 51921 1 285 323 PRO . 51921 1 286 324 TYR . 51921 1 287 325 HIS . 51921 1 288 326 VAL . 51921 1 289 327 ARG . 51921 1 290 328 ARG . 51921 1 291 329 LEU . 51921 1 292 330 MET . 51921 1 293 331 PHE . 51921 1 294 332 VAL . 51921 1 295 333 TYR . 51921 1 296 334 ILE . 51921 1 297 335 SER . 51921 1 298 336 ASP . 51921 1 299 337 GLU . 51921 1 300 338 GLN . 51921 1 301 339 TRP . 51921 1 302 340 THR . 51921 1 303 341 THR . 51921 1 304 342 ALA . 51921 1 305 343 LEU . 51921 1 306 344 PHE . 51921 1 307 345 ASP . 51921 1 308 346 PHE . 51921 1 309 347 TYR . 51921 1 310 348 HIS . 51921 1 311 349 TYR . 51921 1 312 350 PHE . 51921 1 313 351 TYR . 51921 1 314 352 MET . 51921 1 315 353 LEU . 51921 1 316 354 SER . 51921 1 317 355 ASN . 51921 1 318 356 ALA . 51921 1 319 357 LEU . 51921 1 320 358 VAL . 51921 1 321 359 TYR . 51921 1 322 360 VAL . 51921 1 323 361 SER . 51921 1 324 362 ALA . 51921 1 325 363 ALA . 51921 1 326 364 ILE . 51921 1 327 365 ASN . 51921 1 328 366 PRO . 51921 1 329 367 ILE . 51921 1 330 368 LEU . 51921 1 331 369 TYR . 51921 1 332 370 ASN . 51921 1 333 371 LEU . 51921 1 334 372 VAL . 51921 1 335 373 SER . 51921 1 336 374 ALA . 51921 1 337 375 ASN . 51921 1 338 376 PHE . 51921 1 339 377 ARG . 51921 1 340 378 GLN . 51921 1 341 379 VAL . 51921 1 342 380 PHE . 51921 1 343 381 LEU . 51921 1 344 382 SER . 51921 1 345 383 THR . 51921 1 346 384 LEU . 51921 1 347 385 ALA . 51921 1 348 386 SER . 51921 1 349 387 LEU . 51921 1 350 388 SER . 51921 1 351 389 PRO . 51921 1 352 390 GLY . 51921 1 353 391 TRP . 51921 1 354 392 ARG . 51921 1 355 393 HIS . 51921 1 356 394 ARG . 51921 1 357 395 ARG . 51921 1 358 396 LYS . 51921 1 359 397 LYS . 51921 1 360 398 ARG . 51921 1 361 399 PRO . 51921 1 362 400 THR . 51921 1 363 401 PHE . 51921 1 364 402 SER . 51921 1 365 403 ARG . 51921 1 366 404 LYS . 51921 1 367 405 PRO . 51921 1 368 406 ASN . 51921 1 369 407 SER . 51921 1 370 408 VAL . 51921 1 371 409 SER . 51921 1 372 410 SER . 51921 1 373 411 ASN . 51921 1 374 412 HIS . 51921 1 375 413 ALA . 51921 1 376 414 PHE . 51921 1 377 415 SER . 51921 1 378 416 THR . 51921 1 379 417 ALA . 51921 1 380 418 SER . 51921 1 381 419 GLY . 51921 1 382 420 LEU . 51921 1 383 421 ASN . 51921 1 384 422 ASP . 51921 1 385 423 ILE . 51921 1 386 424 PHE . 51921 1 387 425 GLU . 51921 1 388 426 ALA . 51921 1 389 427 GLN . 51921 1 390 428 LYS . 51921 1 391 429 ILE . 51921 1 392 430 GLU . 51921 1 393 431 TRP . 51921 1 394 432 HIS . 51921 1 395 433 GLU . 51921 1 396 434 GLY . 51921 1 397 435 SER . 51921 1 398 436 GLY . 51921 1 399 437 LEU . 51921 1 400 438 GLU . 51921 1 401 439 VAL . 51921 1 402 440 LEU . 51921 1 403 441 PHE . 51921 1 404 442 GLN . 51921 1 stop_ loop_ _Entity_poly_seq.Hetero _Entity_poly_seq.Mon_ID _Entity_poly_seq.Num _Entity_poly_seq.Comp_index_ID _Entity_poly_seq.Entry_ID _Entity_poly_seq.Entity_ID . GLY 1 1 51921 1 . PRO 2 2 51921 1 . GLY 3 3 51921 1 . SER 4 4 51921 1 . THR 5 5 51921 1 . SER 6 6 51921 1 . GLU 7 7 51921 1 . SER 8 8 51921 1 . ASP 9 9 51921 1 . THR 10 10 51921 1 . ALA 11 11 51921 1 . GLY 12 12 51921 1 . PRO 13 13 51921 1 . ASN 14 14 51921 1 . SER 15 15 51921 1 . ASP 16 16 51921 1 . LEU 17 17 51921 1 . ASP 18 18 51921 1 . VAL 19 19 51921 1 . ASN 20 20 51921 1 . THR 21 21 51921 1 . ASP 22 22 51921 1 . ILE 23 23 51921 1 . TYR 24 24 51921 1 . SER 25 25 51921 1 . LYS 26 26 51921 1 . VAL 27 27 51921 1 . LEU 28 28 51921 1 . VAL 29 29 51921 1 . THR 30 30 51921 1 . ALA 31 31 51921 1 . ILE 32 32 51921 1 . TYR 33 33 51921 1 . LEU 34 34 51921 1 . ALA 35 35 51921 1 . LEU 36 36 51921 1 . PHE 37 37 51921 1 . VAL 38 38 51921 1 . VAL 39 39 51921 1 . GLY 40 40 51921 1 . THR 41 41 51921 1 . VAL 42 42 51921 1 . GLY 43 43 51921 1 . ASN 44 44 51921 1 . GLY 45 45 51921 1 . VAL 46 46 51921 1 . THR 47 47 51921 1 . LEU 48 48 51921 1 . PHE 49 49 51921 1 . THR 50 50 51921 1 . LEU 51 51 51921 1 . ALA 52 52 51921 1 . ARG 53 53 51921 1 . LYS 54 54 51921 1 . LYS 55 55 51921 1 . SER 56 56 51921 1 . LEU 57 57 51921 1 . GLN 58 58 51921 1 . SER 59 59 51921 1 . LEU 60 60 51921 1 . GLN 61 61 51921 1 . SER 62 62 51921 1 . ARG 63 63 51921 1 . VAL 64 64 51921 1 . ASP 65 65 51921 1 . TYR 66 66 51921 1 . TYR 67 67 51921 1 . LEU 68 68 51921 1 . GLY 69 69 51921 1 . SER 70 70 51921 1 . LEU 71 71 51921 1 . ALA 72 72 51921 1 . LEU 73 73 51921 1 . SER 74 74 51921 1 . SER 75 75 51921 1 . LEU 76 76 51921 1 . LEU 77 77 51921 1 . ILE 78 78 51921 1 . LEU 79 79 51921 1 . LEU 80 80 51921 1 . PHE 81 81 51921 1 . ALA 82 82 51921 1 . LEU 83 83 51921 1 . PRO 84 84 51921 1 . VAL 85 85 51921 1 . ASP 86 86 51921 1 . VAL 87 87 51921 1 . TYR 88 88 51921 1 . ASN 89 89 51921 1 . PHE 90 90 51921 1 . ILE 91 91 51921 1 . TRP 92 92 51921 1 . VAL 93 93 51921 1 . HIS 94 94 51921 1 . HIS 95 95 51921 1 . PRO 96 96 51921 1 . TRP 97 97 51921 1 . ALA 98 98 51921 1 . PHE 99 99 51921 1 . GLY 100 100 51921 1 . ASP 101 101 51921 1 . ALA 102 102 51921 1 . GLY 103 103 51921 1 . CYS 104 104 51921 1 . LYS 105 105 51921 1 . GLY 106 106 51921 1 . TYR 107 107 51921 1 . TYR 108 108 51921 1 . PHE 109 109 51921 1 . LEU 110 110 51921 1 . ARG 111 111 51921 1 . GLU 112 112 51921 1 . ALA 113 113 51921 1 . CYS 114 114 51921 1 . THR 115 115 51921 1 . TYR 116 116 51921 1 . ALA 117 117 51921 1 . THR 118 118 51921 1 . ALA 119 119 51921 1 . LEU 120 120 51921 1 . ASN 121 121 51921 1 . VAL 122 122 51921 1 . VAL 123 123 51921 1 . SER 124 124 51921 1 . LEU 125 125 51921 1 . SER 126 126 51921 1 . VAL 127 127 51921 1 . GLU 128 128 51921 1 . ARG 129 129 51921 1 . TYR 130 130 51921 1 . LEU 131 131 51921 1 . ALA 132 132 51921 1 . ILE 133 133 51921 1 . CYS 134 134 51921 1 . HIS 135 135 51921 1 . PRO 136 136 51921 1 . PHE 137 137 51921 1 . LYS 138 138 51921 1 . ALA 139 139 51921 1 . LYS 140 140 51921 1 . THR 141 141 51921 1 . LEU 142 142 51921 1 . LEU 143 143 51921 1 . SER 144 144 51921 1 . ARG 145 145 51921 1 . SER 146 146 51921 1 . ARG 147 147 51921 1 . THR 148 148 51921 1 . LYS 149 149 51921 1 . LYS 150 150 51921 1 . PHE 151 151 51921 1 . ILE 152 152 51921 1 . SER 153 153 51921 1 . ALA 154 154 51921 1 . ILE 155 155 51921 1 . TRP 156 156 51921 1 . LEU 157 157 51921 1 . ALA 158 158 51921 1 . SER 159 159 51921 1 . ALA 160 160 51921 1 . LEU 161 161 51921 1 . LEU 162 162 51921 1 . SER 163 163 51921 1 . LEU 164 164 51921 1 . PRO 165 165 51921 1 . MET 166 166 51921 1 . LEU 167 167 51921 1 . PHE 168 168 51921 1 . THR 169 169 51921 1 . MET 170 170 51921 1 . GLY 171 171 51921 1 . LEU 172 172 51921 1 . GLN 173 173 51921 1 . ASN 174 174 51921 1 . LEU 175 175 51921 1 . SER 176 176 51921 1 . GLY 177 177 51921 1 . ASP 178 178 51921 1 . GLY 179 179 51921 1 . THR 180 180 51921 1 . HIS 181 181 51921 1 . PRO 182 182 51921 1 . GLY 183 183 51921 1 . GLY 184 184 51921 1 . LEU 185 185 51921 1 . VAL 186 186 51921 1 . CYS 187 187 51921 1 . THR 188 188 51921 1 . PRO 189 189 51921 1 . ILE 190 190 51921 1 . VAL 191 191 51921 1 . ASP 192 192 51921 1 . THR 193 193 51921 1 . ALA 194 194 51921 1 . THR 195 195 51921 1 . LEU 196 196 51921 1 . ARG 197 197 51921 1 . VAL 198 198 51921 1 . VAL 199 199 51921 1 . ILE 200 200 51921 1 . GLN 201 201 51921 1 . LEU 202 202 51921 1 . ASN 203 203 51921 1 . THR 204 204 51921 1 . PHE 205 205 51921 1 . MET 206 206 51921 1 . SER 207 207 51921 1 . PHE 208 208 51921 1 . LEU 209 209 51921 1 . PHE 210 210 51921 1 . PRO 211 211 51921 1 . MET 212 212 51921 1 . LEU 213 213 51921 1 . VAL 214 214 51921 1 . ALA 215 215 51921 1 . SER 216 216 51921 1 . ILE 217 217 51921 1 . LEU 218 218 51921 1 . ASN 219 219 51921 1 . THR 220 220 51921 1 . VAL 221 221 51921 1 . ILE 222 222 51921 1 . ALA 223 223 51921 1 . ARG 224 224 51921 1 . ARG 225 225 51921 1 . LEU 226 226 51921 1 . THR 227 227 51921 1 . VAL 228 228 51921 1 . LEU 229 229 51921 1 . VAL 230 230 51921 1 . HIS 231 231 51921 1 . GLN 232 232 51921 1 . ALA 233 233 51921 1 . ALA 234 234 51921 1 . GLU 235 235 51921 1 . GLN 236 236 51921 1 . ALA 237 237 51921 1 . ARG 238 238 51921 1 . VAL 239 239 51921 1 . SER 240 240 51921 1 . THR 241 241 51921 1 . VAL 242 242 51921 1 . GLY 243 243 51921 1 . THR 244 244 51921 1 . HIS 245 245 51921 1 . ASN 246 246 51921 1 . GLY 247 247 51921 1 . LEU 248 248 51921 1 . GLU 249 249 51921 1 . HIS 250 250 51921 1 . SER 251 251 51921 1 . THR 252 252 51921 1 . PHE 253 253 51921 1 . ASN 254 254 51921 1 . VAL 255 255 51921 1 . THR 256 256 51921 1 . ILE 257 257 51921 1 . GLU 258 258 51921 1 . PRO 259 259 51921 1 . GLY 260 260 51921 1 . ARG 261 261 51921 1 . VAL 262 262 51921 1 . GLN 263 263 51921 1 . ALA 264 264 51921 1 . LEU 265 265 51921 1 . ARG 266 266 51921 1 . ARG 267 267 51921 1 . GLY 268 268 51921 1 . VAL 269 269 51921 1 . LEU 270 270 51921 1 . VAL 271 271 51921 1 . LEU 272 272 51921 1 . ARG 273 273 51921 1 . ALA 274 274 51921 1 . VAL 275 275 51921 1 . VAL 276 276 51921 1 . ILE 277 277 51921 1 . ALA 278 278 51921 1 . PHE 279 279 51921 1 . VAL 280 280 51921 1 . VAL 281 281 51921 1 . CYS 282 282 51921 1 . TRP 283 283 51921 1 . LEU 284 284 51921 1 . PRO 285 285 51921 1 . TYR 286 286 51921 1 . HIS 287 287 51921 1 . VAL 288 288 51921 1 . ARG 289 289 51921 1 . ARG 290 290 51921 1 . LEU 291 291 51921 1 . MET 292 292 51921 1 . PHE 293 293 51921 1 . VAL 294 294 51921 1 . TYR 295 295 51921 1 . ILE 296 296 51921 1 . SER 297 297 51921 1 . ASP 298 298 51921 1 . GLU 299 299 51921 1 . GLN 300 300 51921 1 . TRP 301 301 51921 1 . THR 302 302 51921 1 . THR 303 303 51921 1 . ALA 304 304 51921 1 . LEU 305 305 51921 1 . PHE 306 306 51921 1 . ASP 307 307 51921 1 . PHE 308 308 51921 1 . TYR 309 309 51921 1 . HIS 310 310 51921 1 . TYR 311 311 51921 1 . PHE 312 312 51921 1 . TYR 313 313 51921 1 . MET 314 314 51921 1 . LEU 315 315 51921 1 . SER 316 316 51921 1 . ASN 317 317 51921 1 . ALA 318 318 51921 1 . LEU 319 319 51921 1 . VAL 320 320 51921 1 . TYR 321 321 51921 1 . VAL 322 322 51921 1 . SER 323 323 51921 1 . ALA 324 324 51921 1 . ALA 325 325 51921 1 . ILE 326 326 51921 1 . ASN 327 327 51921 1 . PRO 328 328 51921 1 . ILE 329 329 51921 1 . LEU 330 330 51921 1 . TYR 331 331 51921 1 . ASN 332 332 51921 1 . LEU 333 333 51921 1 . VAL 334 334 51921 1 . SER 335 335 51921 1 . ALA 336 336 51921 1 . ASN 337 337 51921 1 . PHE 338 338 51921 1 . ARG 339 339 51921 1 . GLN 340 340 51921 1 . VAL 341 341 51921 1 . PHE 342 342 51921 1 . LEU 343 343 51921 1 . SER 344 344 51921 1 . THR 345 345 51921 1 . LEU 346 346 51921 1 . ALA 347 347 51921 1 . SER 348 348 51921 1 . LEU 349 349 51921 1 . SER 350 350 51921 1 . PRO 351 351 51921 1 . GLY 352 352 51921 1 . TRP 353 353 51921 1 . ARG 354 354 51921 1 . HIS 355 355 51921 1 . ARG 356 356 51921 1 . ARG 357 357 51921 1 . LYS 358 358 51921 1 . LYS 359 359 51921 1 . ARG 360 360 51921 1 . PRO 361 361 51921 1 . THR 362 362 51921 1 . PHE 363 363 51921 1 . SER 364 364 51921 1 . ARG 365 365 51921 1 . LYS 366 366 51921 1 . PRO 367 367 51921 1 . ASN 368 368 51921 1 . SER 369 369 51921 1 . VAL 370 370 51921 1 . SER 371 371 51921 1 . SER 372 372 51921 1 . ASN 373 373 51921 1 . HIS 374 374 51921 1 . ALA 375 375 51921 1 . PHE 376 376 51921 1 . SER 377 377 51921 1 . THR 378 378 51921 1 . ALA 379 379 51921 1 . SER 380 380 51921 1 . GLY 381 381 51921 1 . LEU 382 382 51921 1 . ASN 383 383 51921 1 . ASP 384 384 51921 1 . ILE 385 385 51921 1 . PHE 386 386 51921 1 . GLU 387 387 51921 1 . ALA 388 388 51921 1 . GLN 389 389 51921 1 . LYS 390 390 51921 1 . ILE 391 391 51921 1 . GLU 392 392 51921 1 . TRP 393 393 51921 1 . HIS 394 394 51921 1 . GLU 395 395 51921 1 . GLY 396 396 51921 1 . SER 397 397 51921 1 . GLY 398 398 51921 1 . LEU 399 399 51921 1 . GLU 400 400 51921 1 . VAL 401 401 51921 1 . LEU 402 402 51921 1 . PHE 403 403 51921 1 . GLN 404 404 51921 1 stop_ save_ save_entity_2 _Entity.Sf_category entity _Entity.Sf_framecode entity_2 _Entity.Entry_ID 51921 _Entity.ID 2 _Entity.BMRB_code . _Entity.Name entity_2 _Entity.Type polymer _Entity.Polymer_common_type . _Entity.Polymer_type polypeptide(L) _Entity.Polymer_type_details . _Entity.Polymer_strand_ID . _Entity.Polymer_seq_one_letter_code_can . _Entity.Polymer_seq_one_letter_code ; RRPYIL ; _Entity.Target_identifier . _Entity.Polymer_author_defined_seq . _Entity.Polymer_author_seq_details . _Entity.Ambiguous_conformational_states no _Entity.Ambiguous_chem_comp_sites no _Entity.Nstd_monomer no _Entity.Nstd_chirality no _Entity.Nstd_linkage no _Entity.Nonpolymer_comp_ID . _Entity.Nonpolymer_comp_label . _Entity.Number_of_monomers 6 _Entity.Number_of_nonpolymer_components . _Entity.Paramagnetic no _Entity.Thiol_state 'not present' _Entity.Src_method . _Entity.Parent_entity_ID 2 _Entity.Fragment . _Entity.Mutation . _Entity.EC_number . _Entity.Calc_isoelectric_point . _Entity.Formula_weight 817 _Entity.Formula_weight_exptl . _Entity.Formula_weight_exptl_meth . _Entity.Details . _Entity.DB_query_date . _Entity.DB_query_revised_last_date . loop_ _Entity_biological_function.Biological_function _Entity_biological_function.Entry_ID _Entity_biological_function.Entity_ID 'NTS1 agonist' 51921 2 stop_ loop_ _Entity_comp_index.ID _Entity_comp_index.Auth_seq_ID _Entity_comp_index.Comp_ID _Entity_comp_index.Comp_label _Entity_comp_index.Entry_ID _Entity_comp_index.Entity_ID 1 . ARG . 51921 2 2 . ARG . 51921 2 3 . PRO . 51921 2 4 . TYR . 51921 2 5 . ILE . 51921 2 6 . LEU . 51921 2 stop_ loop_ _Entity_poly_seq.Hetero _Entity_poly_seq.Mon_ID _Entity_poly_seq.Num _Entity_poly_seq.Comp_index_ID _Entity_poly_seq.Entry_ID _Entity_poly_seq.Entity_ID . ARG 1 1 51921 2 . ARG 2 2 51921 2 . PRO 3 3 51921 2 . TYR 4 4 51921 2 . ILE 5 5 51921 2 . LEU 6 6 51921 2 stop_ save_ save_entity_3 _Entity.Sf_category entity _Entity.Sf_framecode entity_3 _Entity.Entry_ID 51921 _Entity.ID 3 _Entity.BMRB_code . _Entity.Name entity_3 _Entity.Type polymer _Entity.Polymer_common_type . _Entity.Polymer_type polypeptide(L) _Entity.Polymer_type_details . _Entity.Polymer_strand_ID . _Entity.Polymer_seq_one_letter_code_can . _Entity.Polymer_seq_one_letter_code ; GPGSGCTLSAEDKAAVERSK MIDRNLREDGEKAAREVKLL LLGAGESGKSTIVKQMKIIH EAGYSEEECKQYKAVVYSNT IQSIIAIIRAMGRLKIDFGD SARADDARQLFVLAGAAEEG FMTAELAGVIKRLWKDSGVQ ACFNRSREYQLNDSAAYYLN DLDRIAQPNYIPTQQDVLRT RVKTTGIVETHFTFKDLHFK MFDVGGQRSERKKWIHCFEG VTAIIFCVALSDYDLVLAED EEMNRMHESMKLFDSICNNK WFTDTSIILFLNKKDLFEEK IKKSPLTICYPEYAGSNTYE EAAAYIQCQFEDLNKRKDTK EIYTHFTCATDTKNVQFVFD AVTDVIIKNNLKEYNLV ; _Entity.Target_identifier . _Entity.Polymer_author_defined_seq . _Entity.Polymer_author_seq_details 'G alpha i with the six C-terminal residues from G alpha q (KEYNLV)' _Entity.Ambiguous_conformational_states yes _Entity.Ambiguous_chem_comp_sites no _Entity.Nstd_monomer no _Entity.Nstd_chirality no _Entity.Nstd_linkage no _Entity.Nonpolymer_comp_ID . _Entity.Nonpolymer_comp_label . _Entity.Number_of_monomers 357 _Entity.Number_of_nonpolymer_components . _Entity.Paramagnetic no _Entity.Thiol_state 'all free' _Entity.Src_method . _Entity.Parent_entity_ID 3 _Entity.Fragment . _Entity.Mutation . _Entity.EC_number . _Entity.Calc_isoelectric_point . _Entity.Formula_weight 40611.26 _Entity.Formula_weight_exptl . _Entity.Formula_weight_exptl_meth . _Entity.Details ; The first two residues (GLY1 & PRO2) are a remnant from HRV 3C cleavage, followed by a short linker (GLY3 & SER4); Galpha-iq starts at GLY5. ; _Entity.DB_query_date . _Entity.DB_query_revised_last_date . loop_ _Entity_comp_index.ID _Entity_comp_index.Auth_seq_ID _Entity_comp_index.Comp_ID _Entity_comp_index.Comp_label _Entity_comp_index.Entry_ID _Entity_comp_index.Entity_ID 1 . GLY . 51921 3 2 . PRO . 51921 3 3 . GLY . 51921 3 4 . SER . 51921 3 5 . GLY . 51921 3 6 . CYS . 51921 3 7 . THR . 51921 3 8 . LEU . 51921 3 9 . SER . 51921 3 10 . ALA . 51921 3 11 . GLU . 51921 3 12 . ASP . 51921 3 13 . LYS . 51921 3 14 . ALA . 51921 3 15 . ALA . 51921 3 16 . VAL . 51921 3 17 . GLU . 51921 3 18 . ARG . 51921 3 19 . SER . 51921 3 20 . LYS . 51921 3 21 . MET . 51921 3 22 . ILE . 51921 3 23 . ASP . 51921 3 24 . ARG . 51921 3 25 . ASN . 51921 3 26 . LEU . 51921 3 27 . ARG . 51921 3 28 . GLU . 51921 3 29 . ASP . 51921 3 30 . GLY . 51921 3 31 . GLU . 51921 3 32 . LYS . 51921 3 33 . ALA . 51921 3 34 . ALA . 51921 3 35 . ARG . 51921 3 36 . GLU . 51921 3 37 . VAL . 51921 3 38 . LYS . 51921 3 39 . LEU . 51921 3 40 . LEU . 51921 3 41 . LEU . 51921 3 42 . LEU . 51921 3 43 . GLY . 51921 3 44 . ALA . 51921 3 45 . GLY . 51921 3 46 . GLU . 51921 3 47 . SER . 51921 3 48 . GLY . 51921 3 49 . LYS . 51921 3 50 . SER . 51921 3 51 . THR . 51921 3 52 . ILE . 51921 3 53 . VAL . 51921 3 54 . LYS . 51921 3 55 . GLN . 51921 3 56 . MET . 51921 3 57 . LYS . 51921 3 58 . ILE . 51921 3 59 . ILE . 51921 3 60 . HIS . 51921 3 61 . GLU . 51921 3 62 . ALA . 51921 3 63 . GLY . 51921 3 64 . TYR . 51921 3 65 . SER . 51921 3 66 . GLU . 51921 3 67 . GLU . 51921 3 68 . GLU . 51921 3 69 . CYS . 51921 3 70 . LYS . 51921 3 71 . GLN . 51921 3 72 . TYR . 51921 3 73 . LYS . 51921 3 74 . ALA . 51921 3 75 . VAL . 51921 3 76 . VAL . 51921 3 77 . TYR . 51921 3 78 . SER . 51921 3 79 . ASN . 51921 3 80 . THR . 51921 3 81 . ILE . 51921 3 82 . GLN . 51921 3 83 . SER . 51921 3 84 . ILE . 51921 3 85 . ILE . 51921 3 86 . ALA . 51921 3 87 . ILE . 51921 3 88 . ILE . 51921 3 89 . ARG . 51921 3 90 . ALA . 51921 3 91 . MET . 51921 3 92 . GLY . 51921 3 93 . ARG . 51921 3 94 . LEU . 51921 3 95 . LYS . 51921 3 96 . ILE . 51921 3 97 . ASP . 51921 3 98 . PHE . 51921 3 99 . GLY . 51921 3 100 . ASP . 51921 3 101 . SER . 51921 3 102 . ALA . 51921 3 103 . ARG . 51921 3 104 . ALA . 51921 3 105 . ASP . 51921 3 106 . ASP . 51921 3 107 . ALA . 51921 3 108 . ARG . 51921 3 109 . GLN . 51921 3 110 . LEU . 51921 3 111 . PHE . 51921 3 112 . VAL . 51921 3 113 . LEU . 51921 3 114 . ALA . 51921 3 115 . GLY . 51921 3 116 . ALA . 51921 3 117 . ALA . 51921 3 118 . GLU . 51921 3 119 . GLU . 51921 3 120 . GLY . 51921 3 121 . PHE . 51921 3 122 . MET . 51921 3 123 . THR . 51921 3 124 . ALA . 51921 3 125 . GLU . 51921 3 126 . LEU . 51921 3 127 . ALA . 51921 3 128 . GLY . 51921 3 129 . VAL . 51921 3 130 . ILE . 51921 3 131 . LYS . 51921 3 132 . ARG . 51921 3 133 . LEU . 51921 3 134 . TRP . 51921 3 135 . LYS . 51921 3 136 . ASP . 51921 3 137 . SER . 51921 3 138 . GLY . 51921 3 139 . VAL . 51921 3 140 . GLN . 51921 3 141 . ALA . 51921 3 142 . CYS . 51921 3 143 . PHE . 51921 3 144 . ASN . 51921 3 145 . ARG . 51921 3 146 . SER . 51921 3 147 . ARG . 51921 3 148 . GLU . 51921 3 149 . TYR . 51921 3 150 . GLN . 51921 3 151 . LEU . 51921 3 152 . ASN . 51921 3 153 . ASP . 51921 3 154 . SER . 51921 3 155 . ALA . 51921 3 156 . ALA . 51921 3 157 . TYR . 51921 3 158 . TYR . 51921 3 159 . LEU . 51921 3 160 . ASN . 51921 3 161 . ASP . 51921 3 162 . LEU . 51921 3 163 . ASP . 51921 3 164 . ARG . 51921 3 165 . ILE . 51921 3 166 . ALA . 51921 3 167 . GLN . 51921 3 168 . PRO . 51921 3 169 . ASN . 51921 3 170 . TYR . 51921 3 171 . ILE . 51921 3 172 . PRO . 51921 3 173 . THR . 51921 3 174 . GLN . 51921 3 175 . GLN . 51921 3 176 . ASP . 51921 3 177 . VAL . 51921 3 178 . LEU . 51921 3 179 . ARG . 51921 3 180 . THR . 51921 3 181 . ARG . 51921 3 182 . VAL . 51921 3 183 . LYS . 51921 3 184 . THR . 51921 3 185 . THR . 51921 3 186 . GLY . 51921 3 187 . ILE . 51921 3 188 . VAL . 51921 3 189 . GLU . 51921 3 190 . THR . 51921 3 191 . HIS . 51921 3 192 . PHE . 51921 3 193 . THR . 51921 3 194 . PHE . 51921 3 195 . LYS . 51921 3 196 . ASP . 51921 3 197 . LEU . 51921 3 198 . HIS . 51921 3 199 . PHE . 51921 3 200 . LYS . 51921 3 201 . MET . 51921 3 202 . PHE . 51921 3 203 . ASP . 51921 3 204 . VAL . 51921 3 205 . GLY . 51921 3 206 . GLY . 51921 3 207 . GLN . 51921 3 208 . ARG . 51921 3 209 . SER . 51921 3 210 . GLU . 51921 3 211 . ARG . 51921 3 212 . LYS . 51921 3 213 . LYS . 51921 3 214 . TRP . 51921 3 215 . ILE . 51921 3 216 . HIS . 51921 3 217 . CYS . 51921 3 218 . PHE . 51921 3 219 . GLU . 51921 3 220 . GLY . 51921 3 221 . VAL . 51921 3 222 . THR . 51921 3 223 . ALA . 51921 3 224 . ILE . 51921 3 225 . ILE . 51921 3 226 . PHE . 51921 3 227 . CYS . 51921 3 228 . VAL . 51921 3 229 . ALA . 51921 3 230 . LEU . 51921 3 231 . SER . 51921 3 232 . ASP . 51921 3 233 . TYR . 51921 3 234 . ASP . 51921 3 235 . LEU . 51921 3 236 . VAL . 51921 3 237 . LEU . 51921 3 238 . ALA . 51921 3 239 . GLU . 51921 3 240 . ASP . 51921 3 241 . GLU . 51921 3 242 . GLU . 51921 3 243 . MET . 51921 3 244 . ASN . 51921 3 245 . ARG . 51921 3 246 . MET . 51921 3 247 . HIS . 51921 3 248 . GLU . 51921 3 249 . SER . 51921 3 250 . MET . 51921 3 251 . LYS . 51921 3 252 . LEU . 51921 3 253 . PHE . 51921 3 254 . ASP . 51921 3 255 . SER . 51921 3 256 . ILE . 51921 3 257 . CYS . 51921 3 258 . ASN . 51921 3 259 . ASN . 51921 3 260 . LYS . 51921 3 261 . TRP . 51921 3 262 . PHE . 51921 3 263 . THR . 51921 3 264 . ASP . 51921 3 265 . THR . 51921 3 266 . SER . 51921 3 267 . ILE . 51921 3 268 . ILE . 51921 3 269 . LEU . 51921 3 270 . PHE . 51921 3 271 . LEU . 51921 3 272 . ASN . 51921 3 273 . LYS . 51921 3 274 . LYS . 51921 3 275 . ASP . 51921 3 276 . LEU . 51921 3 277 . PHE . 51921 3 278 . GLU . 51921 3 279 . GLU . 51921 3 280 . LYS . 51921 3 281 . ILE . 51921 3 282 . LYS . 51921 3 283 . LYS . 51921 3 284 . SER . 51921 3 285 . PRO . 51921 3 286 . LEU . 51921 3 287 . THR . 51921 3 288 . ILE . 51921 3 289 . CYS . 51921 3 290 . TYR . 51921 3 291 . PRO . 51921 3 292 . GLU . 51921 3 293 . TYR . 51921 3 294 . ALA . 51921 3 295 . GLY . 51921 3 296 . SER . 51921 3 297 . ASN . 51921 3 298 . THR . 51921 3 299 . TYR . 51921 3 300 . GLU . 51921 3 301 . GLU . 51921 3 302 . ALA . 51921 3 303 . ALA . 51921 3 304 . ALA . 51921 3 305 . TYR . 51921 3 306 . ILE . 51921 3 307 . GLN . 51921 3 308 . CYS . 51921 3 309 . GLN . 51921 3 310 . PHE . 51921 3 311 . GLU . 51921 3 312 . ASP . 51921 3 313 . LEU . 51921 3 314 . ASN . 51921 3 315 . LYS . 51921 3 316 . ARG . 51921 3 317 . LYS . 51921 3 318 . ASP . 51921 3 319 . THR . 51921 3 320 . LYS . 51921 3 321 . GLU . 51921 3 322 . ILE . 51921 3 323 . TYR . 51921 3 324 . THR . 51921 3 325 . HIS . 51921 3 326 . PHE . 51921 3 327 . THR . 51921 3 328 . CYS . 51921 3 329 . ALA . 51921 3 330 . THR . 51921 3 331 . ASP . 51921 3 332 . THR . 51921 3 333 . LYS . 51921 3 334 . ASN . 51921 3 335 . VAL . 51921 3 336 . GLN . 51921 3 337 . PHE . 51921 3 338 . VAL . 51921 3 339 . PHE . 51921 3 340 . ASP . 51921 3 341 . ALA . 51921 3 342 . VAL . 51921 3 343 . THR . 51921 3 344 . ASP . 51921 3 345 . VAL . 51921 3 346 . ILE . 51921 3 347 . ILE . 51921 3 348 . LYS . 51921 3 349 . ASN . 51921 3 350 . ASN . 51921 3 351 . LEU . 51921 3 352 . LYS . 51921 3 353 . GLU . 51921 3 354 . TYR . 51921 3 355 . ASN . 51921 3 356 . LEU . 51921 3 357 . VAL . 51921 3 stop_ loop_ _Entity_poly_seq.Hetero _Entity_poly_seq.Mon_ID _Entity_poly_seq.Num _Entity_poly_seq.Comp_index_ID _Entity_poly_seq.Entry_ID _Entity_poly_seq.Entity_ID . GLY 1 1 51921 3 . PRO 2 2 51921 3 . GLY 3 3 51921 3 . SER 4 4 51921 3 . GLY 5 5 51921 3 . CYS 6 6 51921 3 . THR 7 7 51921 3 . LEU 8 8 51921 3 . SER 9 9 51921 3 . ALA 10 10 51921 3 . GLU 11 11 51921 3 . ASP 12 12 51921 3 . LYS 13 13 51921 3 . ALA 14 14 51921 3 . ALA 15 15 51921 3 . VAL 16 16 51921 3 . GLU 17 17 51921 3 . ARG 18 18 51921 3 . SER 19 19 51921 3 . LYS 20 20 51921 3 . MET 21 21 51921 3 . ILE 22 22 51921 3 . ASP 23 23 51921 3 . ARG 24 24 51921 3 . ASN 25 25 51921 3 . LEU 26 26 51921 3 . ARG 27 27 51921 3 . GLU 28 28 51921 3 . ASP 29 29 51921 3 . GLY 30 30 51921 3 . GLU 31 31 51921 3 . LYS 32 32 51921 3 . ALA 33 33 51921 3 . ALA 34 34 51921 3 . ARG 35 35 51921 3 . GLU 36 36 51921 3 . VAL 37 37 51921 3 . LYS 38 38 51921 3 . LEU 39 39 51921 3 . LEU 40 40 51921 3 . LEU 41 41 51921 3 . LEU 42 42 51921 3 . GLY 43 43 51921 3 . ALA 44 44 51921 3 . GLY 45 45 51921 3 . GLU 46 46 51921 3 . SER 47 47 51921 3 . GLY 48 48 51921 3 . LYS 49 49 51921 3 . SER 50 50 51921 3 . THR 51 51 51921 3 . ILE 52 52 51921 3 . VAL 53 53 51921 3 . LYS 54 54 51921 3 . GLN 55 55 51921 3 . MET 56 56 51921 3 . LYS 57 57 51921 3 . ILE 58 58 51921 3 . ILE 59 59 51921 3 . HIS 60 60 51921 3 . GLU 61 61 51921 3 . ALA 62 62 51921 3 . GLY 63 63 51921 3 . TYR 64 64 51921 3 . SER 65 65 51921 3 . GLU 66 66 51921 3 . GLU 67 67 51921 3 . GLU 68 68 51921 3 . CYS 69 69 51921 3 . LYS 70 70 51921 3 . GLN 71 71 51921 3 . TYR 72 72 51921 3 . LYS 73 73 51921 3 . ALA 74 74 51921 3 . VAL 75 75 51921 3 . VAL 76 76 51921 3 . TYR 77 77 51921 3 . SER 78 78 51921 3 . ASN 79 79 51921 3 . THR 80 80 51921 3 . ILE 81 81 51921 3 . GLN 82 82 51921 3 . SER 83 83 51921 3 . ILE 84 84 51921 3 . ILE 85 85 51921 3 . ALA 86 86 51921 3 . ILE 87 87 51921 3 . ILE 88 88 51921 3 . ARG 89 89 51921 3 . ALA 90 90 51921 3 . MET 91 91 51921 3 . GLY 92 92 51921 3 . ARG 93 93 51921 3 . LEU 94 94 51921 3 . LYS 95 95 51921 3 . ILE 96 96 51921 3 . ASP 97 97 51921 3 . PHE 98 98 51921 3 . GLY 99 99 51921 3 . ASP 100 100 51921 3 . SER 101 101 51921 3 . ALA 102 102 51921 3 . ARG 103 103 51921 3 . ALA 104 104 51921 3 . ASP 105 105 51921 3 . ASP 106 106 51921 3 . ALA 107 107 51921 3 . ARG 108 108 51921 3 . GLN 109 109 51921 3 . LEU 110 110 51921 3 . PHE 111 111 51921 3 . VAL 112 112 51921 3 . LEU 113 113 51921 3 . ALA 114 114 51921 3 . GLY 115 115 51921 3 . ALA 116 116 51921 3 . ALA 117 117 51921 3 . GLU 118 118 51921 3 . GLU 119 119 51921 3 . GLY 120 120 51921 3 . PHE 121 121 51921 3 . MET 122 122 51921 3 . THR 123 123 51921 3 . ALA 124 124 51921 3 . GLU 125 125 51921 3 . LEU 126 126 51921 3 . ALA 127 127 51921 3 . GLY 128 128 51921 3 . VAL 129 129 51921 3 . ILE 130 130 51921 3 . LYS 131 131 51921 3 . ARG 132 132 51921 3 . LEU 133 133 51921 3 . TRP 134 134 51921 3 . LYS 135 135 51921 3 . ASP 136 136 51921 3 . SER 137 137 51921 3 . GLY 138 138 51921 3 . VAL 139 139 51921 3 . GLN 140 140 51921 3 . ALA 141 141 51921 3 . CYS 142 142 51921 3 . PHE 143 143 51921 3 . ASN 144 144 51921 3 . ARG 145 145 51921 3 . SER 146 146 51921 3 . ARG 147 147 51921 3 . GLU 148 148 51921 3 . TYR 149 149 51921 3 . GLN 150 150 51921 3 . LEU 151 151 51921 3 . ASN 152 152 51921 3 . ASP 153 153 51921 3 . SER 154 154 51921 3 . ALA 155 155 51921 3 . ALA 156 156 51921 3 . TYR 157 157 51921 3 . TYR 158 158 51921 3 . LEU 159 159 51921 3 . ASN 160 160 51921 3 . ASP 161 161 51921 3 . LEU 162 162 51921 3 . ASP 163 163 51921 3 . ARG 164 164 51921 3 . ILE 165 165 51921 3 . ALA 166 166 51921 3 . GLN 167 167 51921 3 . PRO 168 168 51921 3 . ASN 169 169 51921 3 . TYR 170 170 51921 3 . ILE 171 171 51921 3 . PRO 172 172 51921 3 . THR 173 173 51921 3 . GLN 174 174 51921 3 . GLN 175 175 51921 3 . ASP 176 176 51921 3 . VAL 177 177 51921 3 . LEU 178 178 51921 3 . ARG 179 179 51921 3 . THR 180 180 51921 3 . ARG 181 181 51921 3 . VAL 182 182 51921 3 . LYS 183 183 51921 3 . THR 184 184 51921 3 . THR 185 185 51921 3 . GLY 186 186 51921 3 . ILE 187 187 51921 3 . VAL 188 188 51921 3 . GLU 189 189 51921 3 . THR 190 190 51921 3 . HIS 191 191 51921 3 . PHE 192 192 51921 3 . THR 193 193 51921 3 . PHE 194 194 51921 3 . LYS 195 195 51921 3 . ASP 196 196 51921 3 . LEU 197 197 51921 3 . HIS 198 198 51921 3 . PHE 199 199 51921 3 . LYS 200 200 51921 3 . MET 201 201 51921 3 . PHE 202 202 51921 3 . ASP 203 203 51921 3 . VAL 204 204 51921 3 . GLY 205 205 51921 3 . GLY 206 206 51921 3 . GLN 207 207 51921 3 . ARG 208 208 51921 3 . SER 209 209 51921 3 . GLU 210 210 51921 3 . ARG 211 211 51921 3 . LYS 212 212 51921 3 . LYS 213 213 51921 3 . TRP 214 214 51921 3 . ILE 215 215 51921 3 . HIS 216 216 51921 3 . CYS 217 217 51921 3 . PHE 218 218 51921 3 . GLU 219 219 51921 3 . GLY 220 220 51921 3 . VAL 221 221 51921 3 . THR 222 222 51921 3 . ALA 223 223 51921 3 . ILE 224 224 51921 3 . ILE 225 225 51921 3 . PHE 226 226 51921 3 . CYS 227 227 51921 3 . VAL 228 228 51921 3 . ALA 229 229 51921 3 . LEU 230 230 51921 3 . SER 231 231 51921 3 . ASP 232 232 51921 3 . TYR 233 233 51921 3 . ASP 234 234 51921 3 . LEU 235 235 51921 3 . VAL 236 236 51921 3 . LEU 237 237 51921 3 . ALA 238 238 51921 3 . GLU 239 239 51921 3 . ASP 240 240 51921 3 . GLU 241 241 51921 3 . GLU 242 242 51921 3 . MET 243 243 51921 3 . ASN 244 244 51921 3 . ARG 245 245 51921 3 . MET 246 246 51921 3 . HIS 247 247 51921 3 . GLU 248 248 51921 3 . SER 249 249 51921 3 . MET 250 250 51921 3 . LYS 251 251 51921 3 . LEU 252 252 51921 3 . PHE 253 253 51921 3 . ASP 254 254 51921 3 . SER 255 255 51921 3 . ILE 256 256 51921 3 . CYS 257 257 51921 3 . ASN 258 258 51921 3 . ASN 259 259 51921 3 . LYS 260 260 51921 3 . TRP 261 261 51921 3 . PHE 262 262 51921 3 . THR 263 263 51921 3 . ASP 264 264 51921 3 . THR 265 265 51921 3 . SER 266 266 51921 3 . ILE 267 267 51921 3 . ILE 268 268 51921 3 . LEU 269 269 51921 3 . PHE 270 270 51921 3 . LEU 271 271 51921 3 . ASN 272 272 51921 3 . LYS 273 273 51921 3 . LYS 274 274 51921 3 . ASP 275 275 51921 3 . LEU 276 276 51921 3 . PHE 277 277 51921 3 . GLU 278 278 51921 3 . GLU 279 279 51921 3 . LYS 280 280 51921 3 . ILE 281 281 51921 3 . LYS 282 282 51921 3 . LYS 283 283 51921 3 . SER 284 284 51921 3 . PRO 285 285 51921 3 . LEU 286 286 51921 3 . THR 287 287 51921 3 . ILE 288 288 51921 3 . CYS 289 289 51921 3 . TYR 290 290 51921 3 . PRO 291 291 51921 3 . GLU 292 292 51921 3 . TYR 293 293 51921 3 . ALA 294 294 51921 3 . GLY 295 295 51921 3 . SER 296 296 51921 3 . ASN 297 297 51921 3 . THR 298 298 51921 3 . TYR 299 299 51921 3 . GLU 300 300 51921 3 . GLU 301 301 51921 3 . ALA 302 302 51921 3 . ALA 303 303 51921 3 . ALA 304 304 51921 3 . TYR 305 305 51921 3 . ILE 306 306 51921 3 . GLN 307 307 51921 3 . CYS 308 308 51921 3 . GLN 309 309 51921 3 . PHE 310 310 51921 3 . GLU 311 311 51921 3 . ASP 312 312 51921 3 . LEU 313 313 51921 3 . ASN 314 314 51921 3 . LYS 315 315 51921 3 . ARG 316 316 51921 3 . LYS 317 317 51921 3 . ASP 318 318 51921 3 . THR 319 319 51921 3 . LYS 320 320 51921 3 . GLU 321 321 51921 3 . ILE 322 322 51921 3 . TYR 323 323 51921 3 . THR 324 324 51921 3 . HIS 325 325 51921 3 . PHE 326 326 51921 3 . THR 327 327 51921 3 . CYS 328 328 51921 3 . ALA 329 329 51921 3 . THR 330 330 51921 3 . ASP 331 331 51921 3 . THR 332 332 51921 3 . LYS 333 333 51921 3 . ASN 334 334 51921 3 . VAL 335 335 51921 3 . GLN 336 336 51921 3 . PHE 337 337 51921 3 . VAL 338 338 51921 3 . PHE 339 339 51921 3 . ASP 340 340 51921 3 . ALA 341 341 51921 3 . VAL 342 342 51921 3 . THR 343 343 51921 3 . ASP 344 344 51921 3 . VAL 345 345 51921 3 . ILE 346 346 51921 3 . ILE 347 347 51921 3 . LYS 348 348 51921 3 . ASN 349 349 51921 3 . ASN 350 350 51921 3 . LEU 351 351 51921 3 . LYS 352 352 51921 3 . GLU 353 353 51921 3 . TYR 354 354 51921 3 . ASN 355 355 51921 3 . LEU 356 356 51921 3 . VAL 357 357 51921 3 stop_ save_ save_entity_4 _Entity.Sf_category entity _Entity.Sf_framecode entity_4 _Entity.Entry_ID 51921 _Entity.ID 4 _Entity.BMRB_code . _Entity.Name entity_4 _Entity.Type non-polymer _Entity.Polymer_common_type . _Entity.Polymer_type . _Entity.Polymer_type_details . _Entity.Polymer_strand_ID . _Entity.Polymer_seq_one_letter_code_can . _Entity.Polymer_seq_one_letter_code . _Entity.Target_identifier . _Entity.Polymer_author_defined_seq . _Entity.Polymer_author_seq_details . _Entity.Ambiguous_conformational_states no _Entity.Ambiguous_chem_comp_sites . _Entity.Nstd_monomer . _Entity.Nstd_chirality no _Entity.Nstd_linkage no _Entity.Nonpolymer_comp_ID . _Entity.Nonpolymer_comp_label . _Entity.Number_of_monomers . _Entity.Number_of_nonpolymer_components . _Entity.Paramagnetic no _Entity.Thiol_state 'not available' _Entity.Src_method . _Entity.Parent_entity_ID 4 _Entity.Fragment . _Entity.Mutation . _Entity.EC_number . _Entity.Calc_isoelectric_point . _Entity.Formula_weight . _Entity.Formula_weight_exptl . _Entity.Formula_weight_exptl_meth . _Entity.Details . _Entity.DB_query_date . _Entity.DB_query_revised_last_date . save_ #################### # Natural source # #################### save_natural_source_1 _Entity_natural_src_list.Sf_category natural_source _Entity_natural_src_list.Sf_framecode natural_source_1 _Entity_natural_src_list.Entry_ID 51921 _Entity_natural_src_list.ID 1 loop_ _Entity_natural_src.ID _Entity_natural_src.Entity_ID _Entity_natural_src.Entity_label _Entity_natural_src.Entity_chimera_segment_ID _Entity_natural_src.NCBI_taxonomy_ID _Entity_natural_src.Type _Entity_natural_src.Common _Entity_natural_src.Organism_name_scientific _Entity_natural_src.Organism_name_common _Entity_natural_src.Organism_acronym _Entity_natural_src.ICTVdb_decimal_code _Entity_natural_src.Superkingdom _Entity_natural_src.Kingdom _Entity_natural_src.Genus _Entity_natural_src.Species _Entity_natural_src.Strain _Entity_natural_src.Variant _Entity_natural_src.Organ _Entity_natural_src.Tissue _Entity_natural_src.Tissue_fraction _Entity_natural_src.Cell_line _Entity_natural_src.Cell_type _Entity_natural_src.ATCC_number _Entity_natural_src.Organelle _Entity_natural_src.Secretion _Entity_natural_src.Plasmid _Entity_natural_src.Gene_mnemonic _Entity_natural_src.Details _Entity_natural_src.Entry_ID _Entity_natural_src.Entity_natural_src_list_ID 1 1 $entity_1 . 10116 organism . 'Rattus norvegicus' Rat . . Eukaryota Metazoa Rattus norvegicus . . . . . . . . . . . . . 51921 1 2 3 $entity_3 . 9606 organism . 'Homo sapiens' Human . . Eukaryota Metazoa Homo sapiens . . . . . . . . . . . . . 51921 1 stop_ save_ ######################### # Experimental source # ######################### save_experimental_source_1 _Entity_experimental_src_list.Sf_category experimental_source _Entity_experimental_src_list.Sf_framecode experimental_source_1 _Entity_experimental_src_list.Entry_ID 51921 _Entity_experimental_src_list.ID 1 loop_ _Entity_experimental_src.ID _Entity_experimental_src.Entity_ID _Entity_experimental_src.Entity_label _Entity_experimental_src.Entity_chimera_segment_ID _Entity_experimental_src.Production_method _Entity_experimental_src.Host_org_scientific_name _Entity_experimental_src.Host_org_name_common _Entity_experimental_src.Host_org_details _Entity_experimental_src.Host_org_NCBI_taxonomy_ID _Entity_experimental_src.Host_org_genus _Entity_experimental_src.Host_org_species _Entity_experimental_src.Host_org_strain _Entity_experimental_src.Host_org_variant _Entity_experimental_src.Host_org_ATCC_number _Entity_experimental_src.Vector_type _Entity_experimental_src.PDBview_host_org_vector_name _Entity_experimental_src.PDBview_plasmid_name _Entity_experimental_src.Vector_name _Entity_experimental_src.Vector_details _Entity_experimental_src.Vendor_name _Entity_experimental_src.Details _Entity_experimental_src.Entry_ID _Entity_experimental_src.Entity_experimental_src_list_ID 1 1 $entity_1 . 'recombinant technology' 'Escherichia coli' . . . Escherichia coli C43(DE3) . . plasmid . . pDS170 . . 'MBP-enNTS1DM4-muGFP fusion construct' 51921 1 2 3 $entity_3 . 'recombinant technology' 'Escherichia coli' . . . Escherichia coli BL21(DE3) . . plasmid . . pIQ . . . 51921 1 stop_ save_ ##################################### # Sample contents and methodology # ##################################### ######################## # Sample description # ######################## save_sample_1 _Sample.Sf_category sample _Sample.Sf_framecode sample_1 _Sample.Entry_ID 51921 _Sample.ID 1 _Sample.Name '13CH3-methionine labelled enNTS1DM4, NT8-13 & Giaq bound in presence of PIP2' _Sample.Type solution _Sample.Sub_type . _Sample.Details 'Protein was 13CH3-methionine labelled' _Sample.Aggregate_sample_number 1 _Sample.Solvent_system '100% D2O' _Sample.Preparation_date . _Sample.Preparation_expiration_date . _Sample.Polycrystallization_protocol . _Sample.Single_crystal_protocol . _Sample.Crystal_grow_apparatus . _Sample.Crystal_grow_atmosphere . _Sample.Crystal_grow_details . _Sample.Crystal_grow_method . _Sample.Crystal_grow_method_cit_ID . _Sample.Crystal_grow_pH . _Sample.Crystal_grow_pH_range . _Sample.Crystal_grow_pressure . _Sample.Crystal_grow_pressure_esd . _Sample.Crystal_grow_seeding . _Sample.Crystal_grow_seeding_cit_ID . _Sample.Crystal_grow_temp . _Sample.Crystal_grow_temp_details . _Sample.Crystal_grow_temp_esd . _Sample.Crystal_grow_time . _Sample.Oriented_sample_prep_protocol . _Sample.Lyophilization_cryo_protectant . _Sample.Storage_protocol . loop_ _Sample_component.ID _Sample_component.Mol_common_name _Sample_component.Isotopic_labeling _Sample_component.Assembly_ID _Sample_component.Assembly_label _Sample_component.Entity_ID _Sample_component.Entity_label _Sample_component.Product_ID _Sample_component.Type _Sample_component.Concentration_val _Sample_component.Concentration_val_min _Sample_component.Concentration_val_max _Sample_component.Concentration_val_units _Sample_component.Concentration_val_err _Sample_component.Vendor _Sample_component.Vendor_product_name _Sample_component.Vendor_product_code _Sample_component.Entry_ID _Sample_component.Sample_ID 1 enNTS1DM4 [13CH3-methionine] . . 1 $entity_1 . . 64 . . uM . . . . 51921 1 2 'potassium phosphate' 'natural abundance' . . . . . . 50 . . mM . . . . 51921 1 3 NaCl 'natural abundance' . . . . . . 100 . . mM . . . . 51921 1 4 DSS 'natural abundance' . . . . . . 20 . . uM . . . . 51921 1 5 DDM 'natural abundance' . . . . . . 0.05 . . % . . . . 51921 1 6 NT8-13 'natural abundance' . . . . . . 500 . . uM . . . . 51921 1 7 'G alpha i/q chimera' 'natural abundance' . . . . . . 145 . . uM . . . . 51921 1 8 '08:0 PI(4,5)P2' 'natural abundance' . . . . . . 130 . . uM . . . . 51921 1 stop_ save_ ####################### # Sample conditions # ####################### save_sample_conditions_1 _Sample_condition_list.Sf_category sample_conditions _Sample_condition_list.Sf_framecode sample_conditions_1 _Sample_condition_list.Entry_ID 51921 _Sample_condition_list.ID 1 _Sample_condition_list.Name 'Room temperature conditions' _Sample_condition_list.Details 'buffer contained 50mM Potassium phosphate, 100mM NaCl, 20uM DSS, >0.05% DDM' loop_ _Sample_condition_variable.Type _Sample_condition_variable.Val _Sample_condition_variable.Val_err _Sample_condition_variable.Val_units _Sample_condition_variable.Entry_ID _Sample_condition_variable.Sample_condition_list_ID 'ionic strength' 150 . mM 51921 1 pH 7.4 . pH 51921 1 pressure 1 . atm 51921 1 temperature 298 . K 51921 1 stop_ save_ ############################ # Computer software used # ############################ save_software_1 _Software.Sf_category software _Software.Sf_framecode software_1 _Software.Entry_ID 51921 _Software.ID 1 _Software.Type . _Software.Name SPARKY _Software.Version . _Software.DOI . _Software.Details . loop_ _Task.Task _Task.Software_module _Task.Entry_ID _Task.Software_ID 'chemical shift assignment' . 51921 1 'data analysis' . 51921 1 stop_ save_ save_software_2 _Software.Sf_category software _Software.Sf_framecode software_2 _Software.Entry_ID 51921 _Software.ID 2 _Software.Type . _Software.Name TOPSPIN _Software.Version . _Software.DOI . _Software.Details . loop_ _Task.Task _Task.Software_module _Task.Entry_ID _Task.Software_ID 'data collection' . 51921 2 stop_ save_ save_software_3 _Software.Sf_category software _Software.Sf_framecode software_3 _Software.Entry_ID 51921 _Software.ID 3 _Software.Type . _Software.Name qMDD _Software.Version . _Software.DOI . _Software.Details . loop_ _Task.Task _Task.Software_module _Task.Entry_ID _Task.Software_ID processing . 51921 3 stop_ save_ ######################### # Experimental detail # ######################### ################################## # NMR Spectrometer definitions # ################################## save_NMR_spectrometer_1 _NMR_spectrometer.Sf_category NMR_spectrometer _NMR_spectrometer.Sf_framecode NMR_spectrometer_1 _NMR_spectrometer.Entry_ID 51921 _NMR_spectrometer.ID 1 _NMR_spectrometer.Name '600MHz Indiana University, Bloomington' _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Bruker _NMR_spectrometer.Model 'AVANCE NEO' _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 600 save_ ############################# # NMR applied experiments # ############################# save_experiment_list_1 _Experiment_list.Sf_category experiment_list _Experiment_list.Sf_framecode experiment_list_1 _Experiment_list.Entry_ID 51921 _Experiment_list.ID 1 _Experiment_list.Details . loop_ _Experiment.ID _Experiment.Name _Experiment.Raw_data_flag _Experiment.NUS_flag _Experiment.Interleaved_flag _Experiment.NMR_spec_expt_ID _Experiment.NMR_spec_expt_label _Experiment.MS_expt_ID _Experiment.MS_expt_label _Experiment.SAXS_expt_ID _Experiment.SAXS_expt_label _Experiment.FRET_expt_ID _Experiment.FRET_expt_label _Experiment.EMR_expt_ID _Experiment.EMR_expt_label _Experiment.Sample_ID _Experiment.Sample_label _Experiment.Sample_state _Experiment.Sample_volume _Experiment.Sample_volume_units _Experiment.Sample_condition_list_ID _Experiment.Sample_condition_list_label _Experiment.Sample_spinning_rate _Experiment.Sample_angle _Experiment.NMR_tube_type _Experiment.NMR_spectrometer_ID _Experiment.NMR_spectrometer_label _Experiment.NMR_spectrometer_probe_ID _Experiment.NMR_spectrometer_probe_label _Experiment.NMR_spectral_processing_ID _Experiment.NMR_spectral_processing_label _Experiment.Mass_spectrometer_ID _Experiment.Mass_spectrometer_label _Experiment.Xray_instrument_ID _Experiment.Xray_instrument_label _Experiment.Fluorescence_instrument_ID _Experiment.Fluorescence_instrument_label _Experiment.EMR_instrument_ID _Experiment.EMR_instrument_label _Experiment.Chromatographic_system_ID _Experiment.Chromatographic_system_label _Experiment.Chromatographic_column_ID _Experiment.Chromatographic_column_label _Experiment.Details _Experiment.Entry_ID _Experiment.Experiment_list_ID 1 '2D 1H-13C HMQC' no yes no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . SOFAST-HMQC 51921 1 stop_ save_ #################### # NMR parameters # #################### ############################## # Assigned chemical shifts # ############################## ################################ # Chemical shift referencing # ################################ save_chem_shift_reference_1 _Chem_shift_reference.Sf_category chem_shift_reference _Chem_shift_reference.Sf_framecode chem_shift_reference_1 _Chem_shift_reference.Entry_ID 51921 _Chem_shift_reference.ID 1 _Chem_shift_reference.Name DSS _Chem_shift_reference.Details . loop_ _Chem_shift_ref.Atom_type _Chem_shift_ref.Atom_isotope_number _Chem_shift_ref.Mol_common_name _Chem_shift_ref.Atom_group _Chem_shift_ref.Concentration_val _Chem_shift_ref.Concentration_units _Chem_shift_ref.Solvent _Chem_shift_ref.Rank _Chem_shift_ref.Chem_shift_units _Chem_shift_ref.Chem_shift_val _Chem_shift_ref.Ref_method _Chem_shift_ref.Ref_type _Chem_shift_ref.Indirect_shift_ratio _Chem_shift_ref.External_ref_loc _Chem_shift_ref.External_ref_sample_geometry _Chem_shift_ref.External_ref_axis _Chem_shift_ref.Ref_correction_type _Chem_shift_ref.Correction_val _Chem_shift_ref.Entry_ID _Chem_shift_ref.Chem_shift_reference_ID C 13 DSS 'methyl protons' . . . . ppm 0.00 na indirect 0.251449530 . . . . . 51921 1 H 1 DSS 'methyl protons' . . . . ppm 0.00 internal direct 1.000000000 . . . . . 51921 1 stop_ save_ ################################### # Assigned chemical shift lists # ################################### ################################################################### # Chemical Shift Ambiguity Index Value Definitions # # # # The values other than 1 are used for those atoms with different # # chemical shifts that cannot be assigned to stereospecific atoms # # or to specific residues or chains. # # # # Index Value Definition # # # # 1 Unique (including isolated methyl protons, # # geminal atoms, and geminal methyl # # groups with identical chemical shifts) # # (e.g. ILE HD11, HD12, HD13 protons) # # 2 Ambiguity of geminal atoms or geminal methyl # # proton groups (e.g. ASP HB2 and HB3 # # protons, LEU CD1 and CD2 carbons, or # # LEU HD11, HD12, HD13 and HD21, HD22, # # HD23 methyl protons) # # 3 Aromatic atoms on opposite sides of # # symmetrical rings (e.g. TYR HE1 and HE2 # # protons) # # 4 Intraresidue ambiguities (e.g. LYS HG and # # HD protons or TRP HZ2 and HZ3 protons) # # 5 Interresidue ambiguities (LYS 12 vs. LYS 27) # # 6 Intermolecular ambiguities (e.g. ASP 31 CA # # in monomer 1 and ASP 31 CA in monomer 2 # # of an asymmetrical homodimer, duplex # # DNA assignments, or other assignments # # that may apply to atoms in one or more # # molecule in the molecular assembly) # # 9 Ambiguous, specific ambiguity not defined # # # ################################################################### save_assigned_chemical_shifts_1 _Assigned_chem_shift_list.Sf_category assigned_chemical_shifts _Assigned_chem_shift_list.Sf_framecode assigned_chemical_shifts_1 _Assigned_chem_shift_list.Entry_ID 51921 _Assigned_chem_shift_list.ID 1 _Assigned_chem_shift_list.Name 'NT8-13 bound enNTS1DM4 13CH3-Met (experiment 1)' _Assigned_chem_shift_list.Sample_condition_list_ID 1 _Assigned_chem_shift_list.Sample_condition_list_label $sample_conditions_1 _Assigned_chem_shift_list.Chem_shift_reference_ID 1 _Assigned_chem_shift_list.Chem_shift_reference_label $chem_shift_reference_1 _Assigned_chem_shift_list.Chem_shift_1H_err . _Assigned_chem_shift_list.Chem_shift_13C_err . _Assigned_chem_shift_list.Chem_shift_15N_err . _Assigned_chem_shift_list.Chem_shift_31P_err . _Assigned_chem_shift_list.Chem_shift_2H_err . _Assigned_chem_shift_list.Chem_shift_19F_err . _Assigned_chem_shift_list.Error_derivation_method . _Assigned_chem_shift_list.Details 'Multiple peaks (in slow exchange) were observed for residues M204 & M352' _Assigned_chem_shift_list.Text_data_format . _Assigned_chem_shift_list.Text_data . loop_ _Chem_shift_experiment.Experiment_ID _Chem_shift_experiment.Experiment_name _Chem_shift_experiment.Sample_ID _Chem_shift_experiment.Sample_label _Chem_shift_experiment.Sample_state _Chem_shift_experiment.Entry_ID _Chem_shift_experiment.Assigned_chem_shift_list_ID 1 '2D 1H-13C HMQC' . . . 51921 1 stop_ loop_ _Chem_shift_software.Software_ID _Chem_shift_software.Software_label _Chem_shift_software.Method_ID _Chem_shift_software.Method_label _Chem_shift_software.Entry_ID _Chem_shift_software.Assigned_chem_shift_list_ID 3 $software_3 . . 51921 1 stop_ loop_ _Atom_chem_shift.ID _Atom_chem_shift.Assembly_atom_ID _Atom_chem_shift.Entity_assembly_ID _Atom_chem_shift.Entity_assembly_asym_ID _Atom_chem_shift.Entity_ID _Atom_chem_shift.Comp_index_ID _Atom_chem_shift.Seq_ID _Atom_chem_shift.Comp_ID _Atom_chem_shift.Atom_ID _Atom_chem_shift.Atom_type _Atom_chem_shift.Atom_isotope_number _Atom_chem_shift.Val _Atom_chem_shift.Val_err _Atom_chem_shift.Assign_fig_of_merit _Atom_chem_shift.Ambiguity_code _Atom_chem_shift.Ambiguity_set_ID _Atom_chem_shift.Occupancy _Atom_chem_shift.Resonance_ID _Atom_chem_shift.Auth_entity_assembly_ID _Atom_chem_shift.Auth_asym_ID _Atom_chem_shift.Auth_seq_ID _Atom_chem_shift.Auth_comp_ID _Atom_chem_shift.Auth_atom_ID _Atom_chem_shift.Details _Atom_chem_shift.Entry_ID _Atom_chem_shift.Assigned_chem_shift_list_ID 1 . 1 . 1 166 166 MET HE1 H 1 2.037 . . 1 . . . . . 204 M HE . 51921 1 2 . 1 . 1 166 166 MET HE2 H 1 2.037 . . 1 . . . . . 204 M HE . 51921 1 3 . 1 . 1 166 166 MET HE3 H 1 2.037 . . 1 . . . . . 204 M HE . 51921 1 4 . 1 . 1 166 166 MET CE C 13 15.942 . . 1 . . . . . 204 M CE . 51921 1 5 . 1 . 1 206 206 MET HE1 H 1 1.907 . . 1 . . . . . 244 M HE . 51921 1 6 . 1 . 1 206 206 MET HE2 H 1 1.907 . . 1 . . . . . 244 M HE . 51921 1 7 . 1 . 1 206 206 MET HE3 H 1 1.907 . . 1 . . . . . 244 M HE . 51921 1 8 . 1 . 1 206 206 MET CE C 13 16.227 . . 1 . . . . . 244 M CE . 51921 1 9 . 1 . 1 212 212 MET HE1 H 1 1.628 . . 1 . . . . . 250 M HE . 51921 1 10 . 1 . 1 212 212 MET HE2 H 1 1.628 . . 1 . . . . . 250 M HE . 51921 1 11 . 1 . 1 212 212 MET HE3 H 1 1.628 . . 1 . . . . . 250 M HE . 51921 1 12 . 1 . 1 212 212 MET CE C 13 17.700 . . 1 . . . . . 250 M CE . 51921 1 13 . 1 . 1 292 292 MET HE1 H 1 2.141 . . 1 . . . . . 330 M HE . 51921 1 14 . 1 . 1 292 292 MET HE2 H 1 2.141 . . 1 . . . . . 330 M HE . 51921 1 15 . 1 . 1 292 292 MET HE3 H 1 2.141 . . 1 . . . . . 330 M HE . 51921 1 16 . 1 . 1 292 292 MET CE C 13 17.399 . . 1 . . . . . 330 M CE . 51921 1 17 . 1 . 1 314 314 MET HE1 H 1 1.965 . . 1 . . . . . 352 M HE . 51921 1 18 . 1 . 1 314 314 MET HE2 H 1 1.965 . . 1 . . . . . 352 M HE . 51921 1 19 . 1 . 1 314 314 MET HE3 H 1 1.965 . . 1 . . . . . 352 M HE . 51921 1 20 . 1 . 1 314 314 MET CE C 13 17.769 . . 1 . . . . . 352 M CE . 51921 1 21 . 2 . 1 166 166 MET HE1 H 1 2.026 . . 1 . . . . . 204 M HE . 51921 1 22 . 2 . 1 166 166 MET HE2 H 1 2.026 . . 1 . . . . . 204 M HE . 51921 1 23 . 2 . 1 166 166 MET HE3 H 1 2.026 . . 1 . . . . . 204 M HE . 51921 1 24 . 2 . 1 166 166 MET CE C 13 16.024 . . 1 . . . . . 204 M CE . 51921 1 25 . 2 . 1 314 314 MET HE1 H 1 2.070 . . 1 . . . . . 352 M HE . 51921 1 26 . 2 . 1 314 314 MET HE2 H 1 2.070 . . 1 . . . . . 352 M HE . 51921 1 27 . 2 . 1 314 314 MET HE3 H 1 2.070 . . 1 . . . . . 352 M HE . 51921 1 28 . 2 . 1 314 314 MET CE C 13 17.255 . . 1 . . . . . 352 M CE . 51921 1 29 . 3 . 1 166 166 MET HE1 H 1 2.017 . . 1 . . . . . 204 M HE . 51921 1 30 . 3 . 1 166 166 MET HE2 H 1 2.017 . . 1 . . . . . 204 M HE . 51921 1 31 . 3 . 1 166 166 MET HE3 H 1 2.017 . . 1 . . . . . 204 M HE . 51921 1 32 . 3 . 1 166 166 MET CE C 13 15.918 . . 1 . . . . . 204 M CE . 51921 1 33 . 3 . 1 314 314 MET HE1 H 1 2.066 . . 1 . . . . . 352 M HE . 51921 1 34 . 3 . 1 314 314 MET HE2 H 1 2.066 . . 1 . . . . . 352 M HE . 51921 1 35 . 3 . 1 314 314 MET HE3 H 1 2.066 . . 1 . . . . . 352 M HE . 51921 1 36 . 3 . 1 314 314 MET CE C 13 17.316 . . 1 . . . . . 352 M CE . 51921 1 37 . 4 . 1 166 166 MET HE1 H 1 2.004 . . 1 . . . . . 204 M HE . 51921 1 38 . 4 . 1 166 166 MET HE2 H 1 2.004 . . 1 . . . . . 204 M HE . 51921 1 39 . 4 . 1 166 166 MET HE3 H 1 2.004 . . 1 . . . . . 204 M HE . 51921 1 40 . 4 . 1 166 166 MET CE C 13 15.976 . . 1 . . . . . 204 M CE . 51921 1 41 . 5 . 1 166 166 MET HE1 H 1 1.993 . . 1 . . . . . 204 M HE . 51921 1 42 . 5 . 1 166 166 MET HE2 H 1 1.993 . . 1 . . . . . 204 M HE . 51921 1 43 . 5 . 1 166 166 MET HE3 H 1 1.993 . . 1 . . . . . 204 M HE . 51921 1 44 . 5 . 1 166 166 MET CE C 13 15.983 . . 1 . . . . . 204 M CE . 51921 1 stop_ save_