data_26315 ####################### # Entry information # ####################### save_entry_information_1 _Entry.Sf_category entry_information _Entry.Sf_framecode entry_information_1 _Entry.ID 26315 _Entry.Title ; Backbone 1H, 15N and HA Chemical Shift Assignments for Paip2A(25-83) ; _Entry.Type macromolecule _Entry.Version_type original _Entry.Submission_date 2021-09-07 _Entry.Accession_date 2021-09-12 _Entry.Last_release_date 2021-09-12 _Entry.Original_release_date 2021-09-12 _Entry.Origination author _Entry.Format_name . _Entry.NMR_STAR_version 3.2.14.0 _Entry.NMR_STAR_dict_location . _Entry.Original_NMR_STAR_version 3.2.0.16 _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 Takeru Sagae . . . . 26315 2 Mariko Yokogawa . . . . 26315 3 Masanori Osawa . . . . 26315 stop_ loop_ _Data_set.Type _Data_set.Count _Data_set.Entry_ID assigned_chemical_shifts 1 26315 stop_ loop_ _Datum.Type _Datum.Count _Datum.Entry_ID '15N chemical shifts' 47 26315 '1H chemical shifts' 93 26315 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 1 . . 2022-05-11 . original BMRB . 26315 stop_ loop_ _Related_entries.Database_name _Related_entries.Database_accession_code _Related_entries.Relationship _Related_entries.Entry_ID BMRB 26314 'Backbone 1H, 13C, 15N and Side chain CB Chemical Shift Assignments for Paip2A' 26315 BMRB 26316 'Backbone 1H, 13C, 15N, HA and Side chain 13C Chemical Shift Assignments for RRM2 of PABPC1' 26315 BMRB 26317 'Backbone 1H, 13C, 15N, HA and Side Chain 13C Chemical Shift Assignments for RRM3 of PABPC1' 26315 BMRB 26318 'Backbone 1H, 13C, 15N and CB Chemical Shift Assignments for RRM2/3' 26315 BMRB 26319 'Backbone 1H, 13C, 15N and CB Chemical Shift Assignments for RRM2/3 when in complex with 12mers of adenine' 26315 BMRB 26320 'Backbone 1H, 13C, and 15N Chemical Shift Assignments for RRM2/3 in complex with Paip2A(25-83)' 26315 BMRB 26323 'Backbone 1H, 13C, and 15N Chemical Shift Assignments for Paip2A(25-83) in complex with RRM2/3' 26315 BMRB 26326 'CA, CB, and CO Chemical Shift Assignments for Paip2A(25-83)' 26315 stop_ save_ ############### # Citations # ############### save_citations_1 _Citation.Sf_category citations _Citation.Sf_framecode citations_1 _Citation.Entry_ID 26315 _Citation.ID 1 _Citation.Name . _Citation.Class 'entry citation' _Citation.CAS_abstract_code . _Citation.MEDLINE_UI_code . _Citation.PubMed_ID 35307347 _Citation.DOI . _Citation.Full_citation . _Citation.Title ; Paip2 competitively dissociates PABPC1 from poly(A) by initial access to RRM2 of the poly(A)-bound PABPC1 ; _Citation.Status published _Citation.Type journal _Citation.Journal_abbrev 'J. Biol. Chem.' _Citation.Journal_name_full . _Citation.Journal_volume 298 _Citation.Journal_issue 5 _Citation.Journal_ASTM . _Citation.Journal_ISSN 1083-351X _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 101844 _Citation.Page_last 101844 _Citation.Year 2022 _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 Takeru Sagae . . . . 26315 1 2 Mariko Yokogawa . . . . 26315 1 3 Ryoichi Sawazaki . . . . 26315 1 4 Yuichiro Ishii . . . . 26315 1 5 Nao Hosoda . . . . 26315 1 6 Shin-ichi Hoshino . . . . 26315 1 7 Shunsuke Imai . . . . 26315 1 8 Ichio Shimada . . . . 26315 1 9 Masanori Osawa . . . . 26315 1 stop_ save_ ############################################# # Molecular system (assembly) description # ############################################# save_assembly_1 _Assembly.Sf_category assembly _Assembly.Sf_framecode assembly_1 _Assembly.Entry_ID 26315 _Assembly.ID 1 _Assembly.Name 'Paip2A(25-83) monomer' _Assembly.BMRB_code . _Assembly.Number_of_components 1 _Assembly.Organic_ligands 0 _Assembly.Metal_ions 0 _Assembly.Non_standard_bonds no _Assembly.Ambiguous_conformational_states yes _Assembly.Ambiguous_chem_comp_sites . _Assembly.Molecules_in_chemical_exchange no _Assembly.Paramagnetic no _Assembly.Thiol_state . _Assembly.Molecular_mass 7995 _Assembly.Enzyme_commission_number . _Assembly.Details . _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 'subunit 1' 1 $entity_1 . . yes native yes no . . . 26315 1 stop_ save_ #################################### # Biological polymers and ligands # #################################### save_entity_1 _Entity.Sf_category entity _Entity.Sf_framecode entity_1 _Entity.Entry_ID 26315 _Entity.ID 1 _Entity.BMRB_code . _Entity.Name Paip2A(25-83) _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 ; GPLGSHEDDNPFAEYMWMEN EEEFNRQIEEELWEEEFIER CFQEMLEEEEEHEWFIPARD LPQT ; _Entity.Target_identifier . _Entity.Polymer_author_defined_seq . _Entity.Polymer_author_seq_details . _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 64 _Entity.Number_of_nonpolymer_components . _Entity.Paramagnetic no _Entity.Thiol_state 'all free' _Entity.Src_method . _Entity.Parent_entity_ID . _Entity.Fragment . _Entity.Mutation . _Entity.EC_number . _Entity.Calc_isoelectric_point . _Entity.Formula_weight 7995 _Entity.Formula_weight_exptl . _Entity.Formula_weight_exptl_meth . _Entity.Details 'Paip2A(25-83) is a peptide with amono acid numbers 25-83 of Paip2A.' _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 -5 GLY . 26315 1 2 -4 PRO . 26315 1 3 -3 LEU . 26315 1 4 -2 GLY . 26315 1 5 -1 SER . 26315 1 6 25 HIS . 26315 1 7 26 GLU . 26315 1 8 27 ASP . 26315 1 9 28 ASP . 26315 1 10 29 ASN . 26315 1 11 30 PRO . 26315 1 12 31 PHE . 26315 1 13 32 ALA . 26315 1 14 33 GLU . 26315 1 15 34 TYR . 26315 1 16 35 MET . 26315 1 17 36 TRP . 26315 1 18 37 MET . 26315 1 19 38 GLU . 26315 1 20 39 ASN . 26315 1 21 40 GLU . 26315 1 22 41 GLU . 26315 1 23 42 GLU . 26315 1 24 43 PHE . 26315 1 25 44 ASN . 26315 1 26 45 ARG . 26315 1 27 46 GLN . 26315 1 28 47 ILE . 26315 1 29 48 GLU . 26315 1 30 49 GLU . 26315 1 31 50 GLU . 26315 1 32 51 LEU . 26315 1 33 52 TRP . 26315 1 34 53 GLU . 26315 1 35 54 GLU . 26315 1 36 55 GLU . 26315 1 37 56 PHE . 26315 1 38 57 ILE . 26315 1 39 58 GLU . 26315 1 40 59 ARG . 26315 1 41 60 CYS . 26315 1 42 61 PHE . 26315 1 43 62 GLN . 26315 1 44 63 GLU . 26315 1 45 64 MET . 26315 1 46 65 LEU . 26315 1 47 66 GLU . 26315 1 48 67 GLU . 26315 1 49 68 GLU . 26315 1 50 69 GLU . 26315 1 51 70 GLU . 26315 1 52 71 HIS . 26315 1 53 72 GLU . 26315 1 54 73 TRP . 26315 1 55 74 PHE . 26315 1 56 75 ILE . 26315 1 57 76 PRO . 26315 1 58 77 ALA . 26315 1 59 78 ARG . 26315 1 60 79 ASP . 26315 1 61 80 LEU . 26315 1 62 81 PRO . 26315 1 63 82 GLN . 26315 1 64 83 THR . 26315 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 26315 1 . PRO 2 2 26315 1 . LEU 3 3 26315 1 . GLY 4 4 26315 1 . SER 5 5 26315 1 . HIS 6 6 26315 1 . GLU 7 7 26315 1 . ASP 8 8 26315 1 . ASP 9 9 26315 1 . ASN 10 10 26315 1 . PRO 11 11 26315 1 . PHE 12 12 26315 1 . ALA 13 13 26315 1 . GLU 14 14 26315 1 . TYR 15 15 26315 1 . MET 16 16 26315 1 . TRP 17 17 26315 1 . MET 18 18 26315 1 . GLU 19 19 26315 1 . ASN 20 20 26315 1 . GLU 21 21 26315 1 . GLU 22 22 26315 1 . GLU 23 23 26315 1 . PHE 24 24 26315 1 . ASN 25 25 26315 1 . ARG 26 26 26315 1 . GLN 27 27 26315 1 . ILE 28 28 26315 1 . GLU 29 29 26315 1 . GLU 30 30 26315 1 . GLU 31 31 26315 1 . LEU 32 32 26315 1 . TRP 33 33 26315 1 . GLU 34 34 26315 1 . GLU 35 35 26315 1 . GLU 36 36 26315 1 . PHE 37 37 26315 1 . ILE 38 38 26315 1 . GLU 39 39 26315 1 . ARG 40 40 26315 1 . CYS 41 41 26315 1 . PHE 42 42 26315 1 . GLN 43 43 26315 1 . GLU 44 44 26315 1 . MET 45 45 26315 1 . LEU 46 46 26315 1 . GLU 47 47 26315 1 . GLU 48 48 26315 1 . GLU 49 49 26315 1 . GLU 50 50 26315 1 . GLU 51 51 26315 1 . HIS 52 52 26315 1 . GLU 53 53 26315 1 . TRP 54 54 26315 1 . PHE 55 55 26315 1 . ILE 56 56 26315 1 . PRO 57 57 26315 1 . ALA 58 58 26315 1 . ARG 59 59 26315 1 . ASP 60 60 26315 1 . LEU 61 61 26315 1 . PRO 62 62 26315 1 . GLN 63 63 26315 1 . THR 64 64 26315 1 stop_ 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 26315 _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 . 562 organism . 'Escherichia coli' 'E. coli' . . Bacteria . Escherichia coli . . . . . . . . . . . . . 26315 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 26315 _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' . . 562 . . . . . plasmid . . pGEX-6p-1 . . . 26315 1 stop_ save_ ##################################### # Sample contents and methodology # ##################################### ######################## # Sample description # ######################## save_sample_1 _Sample.Sf_category sample _Sample.Sf_framecode sample_1 _Sample.Entry_ID 26315 _Sample.ID 1 _Sample.Name Paip2A(25-83) _Sample.Type solution _Sample.Sub_type . _Sample.Details . _Sample.Aggregate_sample_number 1 _Sample.Solvent_system '90% H2O/10% 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 Paip2A(25-83) '[U-100% 15N]' 1 $assembly_1 1 $entity_1 . protein 90 . . uM . . . . 26315 1 2 'potassium phosphate' 'natural abundance' . . . . . buffer 18 . . mM . . . . 26315 1 3 'sodium chloride' 'natural abundance' . . . . . salt 90 . . mM . . . . 26315 1 4 H2O 'natural abundance' . . . . . solvent 90 . . % . . . . 26315 1 5 D2O '[U-100% 2H]' . . . . . solvent 10 . . % . . . . 26315 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 26315 _Sample_condition_list.ID 1 _Sample_condition_list.Name 'Phosphate buffer' _Sample_condition_list.Details '18 mM KH2PO4-NaOH (pH 6.0), 90 mM NaCl, 0.9 mM DTT, 10% D2O' 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 pH 6.0 . pH 26315 1 pressure 1 . atm 26315 1 temperature 298 . K 26315 1 stop_ save_ ############################ # Computer software used # ############################ save_software_1 _Software.Sf_category software _Software.Sf_framecode software_1 _Software.Entry_ID 26315 _Software.ID 1 _Software.Type . _Software.Name SPARKY _Software.Version 3.190 _Software.DOI . _Software.Details . loop_ _Task.Task _Task.Software_module _Task.Entry_ID _Task.Software_ID 'chemical shift assignment' . 26315 1 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 26315 _NMR_spectrometer.ID 1 _NMR_spectrometer.Name 'Bruker Avance 500' _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Bruker _NMR_spectrometer.Model Avance _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 500 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 26315 _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-15N HSQC' no no . . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . . 26315 1 2 '3D 1H-15N NOESY' no no . . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . . 26315 1 3 '3D 1H-15N TOCSY' no no . . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . . 26315 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 26315 _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 H 1 DSS 'methyl protons' . . . . ppm 0 external direct 1 . . . . . 26315 1 N 15 DSS 'methyl protons' . . . . ppm 0 external indirect 0.101329118 . . . . . 26315 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 26315 _Assigned_chem_shift_list.ID 1 _Assigned_chem_shift_list.Name 'Assigned chemical shift of Paip2A(25-83)' _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 . _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-15N HSQC' 1 $sample_1 isotropic 26315 1 2 '3D 1H-15N NOESY' 1 $sample_1 isotropic 26315 1 3 '3D 1H-15N TOCSY' 1 $sample_1 isotropic 26315 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 1 $software_1 . . 26315 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 3 3 LEU H H 1 8.552 0.003 . 1 . . . . . -3 LEU H . 26315 1 2 . 1 . 1 3 3 LEU HA H 1 4.383 0.039 . 1 . . . . . -3 LEU HA . 26315 1 3 . 1 . 1 3 3 LEU N N 15 122.411 0.008 . 1 . . . . . -3 LEU N . 26315 1 4 . 1 . 1 4 4 GLY H H 1 8.442 0.004 . 1 . . . . . -2 GLY H . 26315 1 5 . 1 . 1 4 4 GLY N N 15 110.196 0.009 . 1 . . . . . -2 GLY N . 26315 1 6 . 1 . 1 5 5 SER H H 1 8.158 0.005 . 1 . . . . . -1 SER H . 26315 1 7 . 1 . 1 5 5 SER HA H 1 3.839 0.000 . 1 . . . . . -1 SER HA . 26315 1 8 . 1 . 1 5 5 SER N N 15 115.644 0.007 . 1 . . . . . -1 SER N . 26315 1 9 . 1 . 1 6 6 HIS H H 1 8.636 0.004 . 1 . . . . . 25 HIS H . 26315 1 10 . 1 . 1 6 6 HIS HA H 1 3.185 0.000 . 1 . . . . . 25 HIS HA . 26315 1 11 . 1 . 1 6 6 HIS N N 15 120.55 0.007 . 1 . . . . . 25 HIS N . 26315 1 12 . 1 . 1 7 7 GLU H H 1 8.499 0.003 . 1 . . . . . 26 GLU H . 26315 1 13 . 1 . 1 7 7 GLU HA H 1 4.763 0.000 . 1 . . . . . 26 GLU HA . 26315 1 14 . 1 . 1 7 7 GLU N N 15 122.159 0.008 . 1 . . . . . 26 GLU N . 26315 1 15 . 1 . 1 8 8 ASP H H 1 8.383 0.003 . 1 . . . . . 27 ASP H . 26315 1 16 . 1 . 1 8 8 ASP HA H 1 4.605 0.001 . 1 . . . . . 27 ASP HA . 26315 1 17 . 1 . 1 8 8 ASP N N 15 120.578 0.011 . 1 . . . . . 27 ASP N . 26315 1 18 . 1 . 1 9 9 ASP H H 1 8.17 0.002 . 1 . . . . . 28 ASP H . 26315 1 19 . 1 . 1 9 9 ASP HA H 1 4.572 0.007 . 1 . . . . . 28 ASP HA . 26315 1 20 . 1 . 1 9 9 ASP N N 15 120.275 0.006 . 1 . . . . . 28 ASP N . 26315 1 21 . 1 . 1 10 10 ASN H H 1 8.292 0.003 . 1 . . . . . 29 ASN H . 26315 1 22 . 1 . 1 10 10 ASN HA H 1 4.937 0.011 . 1 . . . . . 29 ASN HA . 26315 1 23 . 1 . 1 10 10 ASN N N 15 119.313 0.006 . 1 . . . . . 29 ASN N . 26315 1 24 . 1 . 1 12 12 PHE H H 1 8.036 0.002 . 1 . . . . . 31 PHE H . 26315 1 25 . 1 . 1 12 12 PHE HA H 1 4.629 0.003 . 1 . . . . . 31 PHE HA . 26315 1 26 . 1 . 1 12 12 PHE N N 15 118.711 0.007 . 1 . . . . . 31 PHE N . 26315 1 27 . 1 . 1 13 13 ALA H H 1 7.739 0.003 . 1 . . . . . 32 ALA H . 26315 1 28 . 1 . 1 13 13 ALA HA H 1 4.192 0.003 . 1 . . . . . 32 ALA HA . 26315 1 29 . 1 . 1 13 13 ALA N N 15 124.63 0.007 . 1 . . . . . 32 ALA N . 26315 1 30 . 1 . 1 14 14 GLU H H 1 8.234 0.002 . 1 . . . . . 33 GLU H . 26315 1 31 . 1 . 1 14 14 GLU HA H 1 4.112 0.002 . 1 . . . . . 33 GLU HA . 26315 1 32 . 1 . 1 14 14 GLU N N 15 119.147 0.005 . 1 . . . . . 33 GLU N . 26315 1 33 . 1 . 1 15 15 TYR H H 1 7.965 0.002 . 1 . . . . . 34 TYR H . 26315 1 34 . 1 . 1 15 15 TYR HA H 1 4.463 0.014 . 1 . . . . . 34 TYR HA . 26315 1 35 . 1 . 1 15 15 TYR N N 15 120.042 0.009 . 1 . . . . . 34 TYR N . 26315 1 36 . 1 . 1 16 16 MET H H 1 7.993 0.002 . 1 . . . . . 35 MET H . 26315 1 37 . 1 . 1 16 16 MET HA H 1 4.333 0.002 . 1 . . . . . 35 MET HA . 26315 1 38 . 1 . 1 16 16 MET N N 15 122.038 0.008 . 1 . . . . . 35 MET N . 26315 1 39 . 1 . 1 17 17 TRP H H 1 7.902 0.002 . 1 . . . . . 36 TRP H . 26315 1 40 . 1 . 1 17 17 TRP HA H 1 4.606 0.001 . 1 . . . . . 36 TRP HA . 26315 1 41 . 1 . 1 17 17 TRP N N 15 121.646 0.034 . 1 . . . . . 36 TRP N . 26315 1 42 . 1 . 1 18 18 MET H H 1 7.906 0.004 . 1 . . . . . 37 MET H . 26315 1 43 . 1 . 1 18 18 MET HA H 1 4.3 0.004 . 1 . . . . . 37 MET HA . 26315 1 44 . 1 . 1 18 18 MET N N 15 121.866 0.027 . 1 . . . . . 37 MET N . 26315 1 45 . 1 . 1 19 19 GLU H H 1 8.182 0.003 . 1 . . . . . 38 GLU H . 26315 1 46 . 1 . 1 19 19 GLU HA H 1 4.102 0.002 . 1 . . . . . 38 GLU HA . 26315 1 47 . 1 . 1 19 19 GLU N N 15 121.281 0.034 . 1 . . . . . 38 GLU N . 26315 1 48 . 1 . 1 20 20 ASN H H 1 8.337 0.003 . 1 . . . . . 39 ASN H . 26315 1 49 . 1 . 1 20 20 ASN HA H 1 4.713 0.013 . 1 . . . . . 39 ASN HA . 26315 1 50 . 1 . 1 20 20 ASN N N 15 118.922 0.010 . 1 . . . . . 39 ASN N . 26315 1 51 . 1 . 1 21 21 GLU H H 1 8.403 0.004 . 1 . . . . . 40 GLU H . 26315 1 52 . 1 . 1 21 21 GLU HA H 1 4.205 0.008 . 1 . . . . . 40 GLU HA . 26315 1 53 . 1 . 1 21 21 GLU N N 15 121.797 0.006 . 1 . . . . . 40 GLU N . 26315 1 54 . 1 . 1 24 24 PHE H H 1 8.076 0.002 . 1 . . . . . 43 PHE H . 26315 1 55 . 1 . 1 24 24 PHE HA H 1 4.54 0.018 . 1 . . . . . 43 PHE HA . 26315 1 56 . 1 . 1 24 24 PHE N N 15 120.522 0.008 . 1 . . . . . 43 PHE N . 26315 1 57 . 1 . 1 25 25 ASN H H 1 8.28 0.002 . 1 . . . . . 44 ASN H . 26315 1 58 . 1 . 1 25 25 ASN HA H 1 4.642 0.006 . 1 . . . . . 44 ASN HA . 26315 1 59 . 1 . 1 25 25 ASN N N 15 119.898 0.022 . 1 . . . . . 44 ASN N . 26315 1 60 . 1 . 1 26 26 ARG H H 1 8.076 0.002 . 1 . . . . . 45 ARG H . 26315 1 61 . 1 . 1 26 26 ARG HA H 1 4.224 0.004 . 1 . . . . . 45 ARG HA . 26315 1 62 . 1 . 1 26 26 ARG N N 15 121.549 0.024 . 1 . . . . . 45 ARG N . 26315 1 63 . 1 . 1 27 27 GLN H H 1 8.34 0.004 . 1 . . . . . 46 GLN H . 26315 1 64 . 1 . 1 27 27 GLN HA H 1 4.259 0.009 . 1 . . . . . 46 GLN HA . 26315 1 65 . 1 . 1 27 27 GLN N N 15 121.642 0.012 . 1 . . . . . 46 GLN N . 26315 1 66 . 1 . 1 28 28 ILE H H 1 8.057 0.005 . 1 . . . . . 47 ILE H . 26315 1 67 . 1 . 1 28 28 ILE HA H 1 4.071 0.020 . 1 . . . . . 47 ILE HA . 26315 1 68 . 1 . 1 28 28 ILE N N 15 121.742 0.010 . 1 . . . . . 47 ILE N . 26315 1 69 . 1 . 1 29 29 GLU H H 1 8.359 0.003 . 1 . . . . . 48 GLU H . 26315 1 70 . 1 . 1 29 29 GLU HA H 1 4.234 0.001 . 1 . . . . . 48 GLU HA . 26315 1 71 . 1 . 1 29 29 GLU N N 15 124.157 0.011 . 1 . . . . . 48 GLU N . 26315 1 72 . 1 . 1 32 32 LEU H H 1 8.114 0.002 . 1 . . . . . 51 LEU H . 26315 1 73 . 1 . 1 32 32 LEU HA H 1 4.305 0.009 . 1 . . . . . 51 LEU HA . 26315 1 74 . 1 . 1 32 32 LEU N N 15 122.738 0.010 . 1 . . . . . 51 LEU N . 26315 1 75 . 1 . 1 33 33 TRP H H 1 8.094 0.002 . 1 . . . . . 52 TRP H . 26315 1 76 . 1 . 1 33 33 TRP HA H 1 4.661 0.017 . 1 . . . . . 52 TRP HA . 26315 1 77 . 1 . 1 33 33 TRP N N 15 122.078 0.011 . 1 . . . . . 52 TRP N . 26315 1 78 . 1 . 1 34 34 GLU H H 1 8.136 0.002 . 1 . . . . . 53 GLU H . 26315 1 79 . 1 . 1 34 34 GLU HA H 1 4.178 0.002 . 1 . . . . . 53 GLU HA . 26315 1 80 . 1 . 1 34 34 GLU N N 15 122.384 0.007 . 1 . . . . . 53 GLU N . 26315 1 81 . 1 . 1 37 37 PHE H H 1 8.22 0.007 . 1 . . . . . 56 PHE H . 26315 1 82 . 1 . 1 37 37 PHE HA H 1 4.514 0.007 . 1 . . . . . 56 PHE HA . 26315 1 83 . 1 . 1 37 37 PHE N N 15 121.479 0.007 . 1 . . . . . 56 PHE N . 26315 1 84 . 1 . 1 38 38 ILE H H 1 7.897 0.004 . 1 . . . . . 57 ILE H . 26315 1 85 . 1 . 1 38 38 ILE HA H 1 3.981 0.006 . 1 . . . . . 57 ILE HA . 26315 1 86 . 1 . 1 38 38 ILE N N 15 123.073 0.008 . 1 . . . . . 57 ILE N . 26315 1 87 . 1 . 1 39 39 GLU H H 1 8.289 0.003 . 1 . . . . . 58 GLU H . 26315 1 88 . 1 . 1 39 39 GLU HA H 1 4.169 0.005 . 1 . . . . . 58 GLU HA . 26315 1 89 . 1 . 1 39 39 GLU N N 15 124.116 0.014 . 1 . . . . . 58 GLU N . 26315 1 90 . 1 . 1 40 40 ARG H H 1 8.261 0.002 . 1 . . . . . 59 ARG H . 26315 1 91 . 1 . 1 40 40 ARG HA H 1 4.246 0.018 . 1 . . . . . 59 ARG HA . 26315 1 92 . 1 . 1 40 40 ARG N N 15 122.384 0.025 . 1 . . . . . 59 ARG N . 26315 1 93 . 1 . 1 41 41 CYS H H 1 8.276 0.003 . 1 . . . . . 60 CYS H . 26315 1 94 . 1 . 1 41 41 CYS HA H 1 4.378 0.005 . 1 . . . . . 60 CYS HA . 26315 1 95 . 1 . 1 41 41 CYS N N 15 119.779 0.020 . 1 . . . . . 60 CYS N . 26315 1 96 . 1 . 1 42 42 PHE H H 1 8.262 0.002 . 1 . . . . . 61 PHE H . 26315 1 97 . 1 . 1 42 42 PHE HA H 1 4.599 0.007 . 1 . . . . . 61 PHE HA . 26315 1 98 . 1 . 1 42 42 PHE N N 15 122.537 0.016 . 1 . . . . . 61 PHE N . 26315 1 99 . 1 . 1 43 43 GLN H H 1 8.183 0.003 . 1 . . . . . 62 GLN H . 26315 1 100 . 1 . 1 43 43 GLN HA H 1 4.221 0.003 . 1 . . . . . 62 GLN HA . 26315 1 101 . 1 . 1 43 43 GLN N N 15 121.567 0.035 . 1 . . . . . 62 GLN N . 26315 1 102 . 1 . 1 45 45 MET H H 1 8.265 0.002 . 1 . . . . . 64 MET H . 26315 1 103 . 1 . 1 45 45 MET HA H 1 4.446 0.012 . 1 . . . . . 64 MET HA . 26315 1 104 . 1 . 1 45 45 MET N N 15 121.235 0.018 . 1 . . . . . 64 MET N . 26315 1 105 . 1 . 1 46 46 LEU H H 1 8.189 0.003 . 1 . . . . . 65 LEU H . 26315 1 106 . 1 . 1 46 46 LEU HA H 1 4.334 0.007 . 1 . . . . . 65 LEU HA . 26315 1 107 . 1 . 1 46 46 LEU N N 15 123.571 0.010 . 1 . . . . . 65 LEU N . 26315 1 108 . 1 . 1 52 52 HIS H H 1 8.354 0.003 . 1 . . . . . 71 HIS H . 26315 1 109 . 1 . 1 52 52 HIS HA H 1 4.619 0.000 . 1 . . . . . 71 HIS HA . 26315 1 110 . 1 . 1 52 52 HIS N N 15 119.594 0.009 . 1 . . . . . 71 HIS N . 26315 1 111 . 1 . 1 53 53 GLU H H 1 8.497 0.003 . 1 . . . . . 72 GLU H . 26315 1 112 . 1 . 1 53 53 GLU HA H 1 4.224 0.012 . 1 . . . . . 72 GLU HA . 26315 1 113 . 1 . 1 53 53 GLU N N 15 122.161 0.009 . 1 . . . . . 72 GLU N . 26315 1 114 . 1 . 1 54 54 TRP H H 1 8.049 0.003 . 1 . . . . . 73 TRP H . 26315 1 115 . 1 . 1 54 54 TRP HA H 1 4.72 0.018 . 1 . . . . . 73 TRP HA . 26315 1 116 . 1 . 1 54 54 TRP N N 15 121.59 0.037 . 1 . . . . . 73 TRP N . 26315 1 117 . 1 . 1 55 55 PHE H H 1 7.913 0.005 . 1 . . . . . 74 PHE H . 26315 1 118 . 1 . 1 55 55 PHE HA H 1 4.559 0.008 . 1 . . . . . 74 PHE HA . 26315 1 119 . 1 . 1 55 55 PHE N N 15 121.926 0.028 . 1 . . . . . 74 PHE N . 26315 1 120 . 1 . 1 56 56 ILE H H 1 7.962 0.004 . 1 . . . . . 75 ILE H . 26315 1 121 . 1 . 1 56 56 ILE HA H 1 4.324 0.006 . 1 . . . . . 75 ILE HA . 26315 1 122 . 1 . 1 56 56 ILE N N 15 125.813 0.007 . 1 . . . . . 75 ILE N . 26315 1 123 . 1 . 1 58 58 ALA H H 1 8.303 0.003 . 1 . . . . . 77 ALA H . 26315 1 124 . 1 . 1 58 58 ALA HA H 1 4.237 0.006 . 1 . . . . . 77 ALA HA . 26315 1 125 . 1 . 1 58 58 ALA N N 15 123.912 0.029 . 1 . . . . . 77 ALA N . 26315 1 126 . 1 . 1 59 59 ARG H H 1 8.223 0.014 . 1 . . . . . 78 ARG H . 26315 1 127 . 1 . 1 59 59 ARG HA H 1 4.306 0.014 . 1 . . . . . 78 ARG HA . 26315 1 128 . 1 . 1 59 59 ARG N N 15 119.71 0.021 . 1 . . . . . 78 ARG N . 26315 1 129 . 1 . 1 60 60 ASP H H 1 8.303 0.002 . 1 . . . . . 79 ASP H . 26315 1 130 . 1 . 1 60 60 ASP HA H 1 4.64 0.005 . 1 . . . . . 79 ASP HA . 26315 1 131 . 1 . 1 60 60 ASP N N 15 120.757 0.004 . 1 . . . . . 79 ASP N . 26315 1 132 . 1 . 1 61 61 LEU H H 1 8.051 0.002 . 1 . . . . . 80 LEU H . 26315 1 133 . 1 . 1 61 61 LEU HA H 1 4.625 0.016 . 1 . . . . . 80 LEU HA . 26315 1 134 . 1 . 1 61 61 LEU N N 15 123.531 0.013 . 1 . . . . . 80 LEU N . 26315 1 135 . 1 . 1 63 63 GLN H H 1 8.538 0.003 . 1 . . . . . 82 GLN H . 26315 1 136 . 1 . 1 63 63 GLN HA H 1 4.407 0.017 . 1 . . . . . 82 GLN HA . 26315 1 137 . 1 . 1 63 63 GLN N N 15 121.508 0.007 . 1 . . . . . 82 GLN N . 26315 1 138 . 1 . 1 64 64 THR H H 1 7.836 0.004 . 1 . . . . . 83 THR H . 26315 1 139 . 1 . 1 64 64 THR HA H 1 4.163 0.000 . 1 . . . . . 83 THR HA . 26315 1 140 . 1 . 1 64 64 THR N N 15 120.927 0.006 . 1 . . . . . 83 THR N . 26315 1 stop_ save_