data_1587 ####################### # Entry information # ####################### save_entry_information _Entry.Sf_category entry_information _Entry.Sf_framecode entry_information _Entry.ID 1587 _Entry.Title ; Proton Nuclear Magnetic Resonance Study of the B9(Asp)Mutant of Human Insulin Sequential Assignment and Secondary Structure ; _Entry.Type macromolecule _Entry.Version_type update _Entry.Submission_date 1995-07-31 _Entry.Accession_date 1996-04-13 _Entry.Last_release_date . _Entry.Original_release_date . _Entry.Origination BMRB _Entry.NMR_STAR_version 3.1.1.61 _Entry.Original_NMR_STAR_version 2.1 _Entry.Experimental_method NMR _Entry.Experimental_method_subtype . _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.Entry_ID 1 Soren Kristensen . M. . 1587 2 Anne Jorgensen . Marie.M. . 1587 3 Jens Led . J. . 1587 4 Per Balschmidt . . . 1587 5 Finn Hansen . B. . 1587 stop_ loop_ _Data_set.Type _Data_set.Count _Data_set.Entry_ID assigned_chemical_shifts 1 1587 stop_ loop_ _Datum.Type _Datum.Count _Datum.Entry_ID '1H chemical shifts' 2 1587 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 5 . . 2010-06-15 . revision BMRB 'Complete natural source information' 1587 4 . . 1999-06-14 . revision BMRB 'Converted to BMRB NMR-STAR V 2.1 format' 1587 3 . . 1996-04-13 . revision BMRB 'Link to the Protein Data Bank added' 1587 2 . . 1996-03-25 . reformat BMRB 'Converted to the BMRB 1996-03-01 STAR flat-file format' 1587 1 . . 1995-07-31 . original BMRB 'Last release in original BMRB flat-file format' 1587 stop_ save_ ############### # Citations # ############### save_entry_citation _Citation.Sf_category citations _Citation.Sf_framecode entry_citation _Citation.Entry_ID 1587 _Citation.ID 1 _Citation.Class 'entry citation' _Citation.CAS_abstract_code . _Citation.MEDLINE_UI_code . _Citation.DOI . _Citation.PubMed_ID . _Citation.Full_citation ; Kristensen, Soren M., Jorgensen, Anne Marie M., Led, Jens J., Balschmidt, Per, Hansen, Finn B., "Proton Nuclear Magnetic Resonance Study of the B9(Asp)Mutant of Human Insulin Sequential Assignment and Secondary Structure," J. Mol. Biol. 218, 221-231 (1991). ; _Citation.Title ; Proton Nuclear Magnetic Resonance Study of the B9(Asp)Mutant of Human Insulin Sequential Assignment and Secondary Structure ; _Citation.Status published _Citation.Type journal _Citation.Journal_abbrev 'J. Mol. Biol.' _Citation.Journal_name_full . _Citation.Journal_volume 218 _Citation.Journal_issue . _Citation.Journal_ASTM . _Citation.Journal_ISSN . _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 221 _Citation.Page_last 231 _Citation.Year 1991 _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.Entry_ID _Citation_author.Citation_ID 1 Soren Kristensen . M. . 1587 1 2 Anne Jorgensen . Marie.M. . 1587 1 3 Jens Led . J. . 1587 1 4 Per Balschmidt . . . 1587 1 5 Finn Hansen . B. . 1587 1 stop_ save_ ############################################# # Molecular system (assembly) description # ############################################# save_system_insulin_A_chain _Assembly.Sf_category assembly _Assembly.Sf_framecode system_insulin_A_chain _Assembly.Entry_ID 1587 _Assembly.ID 1 _Assembly.Name 'insulin A chain' _Assembly.BMRB_code . _Assembly.Number_of_components . _Assembly.Organic_ligands . _Assembly.Metal_ions . _Assembly.Non_standard_bonds . _Assembly.Ambiguous_conformational_states . _Assembly.Ambiguous_chem_comp_sites . _Assembly.Molecules_in_chemical_exchange . _Assembly.Paramagnetic . _Assembly.Thiol_state . _Assembly.Molecular_mass . _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 'insulin A chain' 1 $insulin_A_chain . . . . . . . . . 1587 1 stop_ loop_ _Assembly_common_name.Name _Assembly_common_name.Type _Assembly_common_name.Entry_ID _Assembly_common_name.Assembly_ID 'insulin A chain' system 1587 1 stop_ save_ #################################### # Biological polymers and ligands # #################################### save_insulin_A_chain _Entity.Sf_category entity _Entity.Sf_framecode insulin_A_chain _Entity.Entry_ID 1587 _Entity.ID 1 _Entity.BMRB_code . _Entity.Name 'insulin A chain' _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 ; XIVEQCCTSICSLYQLENYC N ; _Entity.Polymer_seq_one_letter_code ; XIVEQCCTSICSLYQLENYC N ; _Entity.Target_identifier . _Entity.Polymer_author_defined_seq . _Entity.Polymer_author_seq_details . _Entity.Ambiguous_conformational_states . _Entity.Ambiguous_chem_comp_sites . _Entity.Nstd_monomer . _Entity.Nstd_chirality . _Entity.Nstd_linkage . _Entity.Nonpolymer_comp_ID . _Entity.Nonpolymer_comp_label . _Entity.Number_of_monomers 21 _Entity.Number_of_nonpolymer_components . _Entity.Paramagnetic . _Entity.Thiol_state . _Entity.Src_method . _Entity.Parent_entity_ID 1 _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 2015-11-26 loop_ _Entity_db_link.Ordinal _Entity_db_link.Author_supplied _Entity_db_link.Database_code _Entity_db_link.Accession_code _Entity_db_link.Entry_mol_code _Entity_db_link.Entry_mol_name _Entity_db_link.Entry_experimental_method _Entity_db_link.Entry_structure_resolution _Entity_db_link.Entry_relation_type _Entity_db_link.Entry_details _Entity_db_link.Chimera_segment_ID _Entity_db_link.Seq_query_to_submitted_percent _Entity_db_link.Seq_subject_length _Entity_db_link.Seq_identity _Entity_db_link.Seq_positive _Entity_db_link.Seq_homology_expectation_val _Entity_db_link.Seq_align_begin _Entity_db_link.Seq_align_end _Entity_db_link.Seq_difference_details _Entity_db_link.Seq_alignment_details _Entity_db_link.Entry_ID _Entity_db_link.Entity_ID 1 no BMRB 1000 . "insulin A chain" . . . . . 95.24 21 100.00 100.00 1.28e-03 . . . . 1587 1 2 no BMRB 1002 . "insulin A chain" . . . . . 95.24 21 100.00 100.00 1.28e-03 . . . . 1587 1 3 no BMRB 1004 . "insulin A chain" . . . . . 95.24 21 100.00 100.00 1.28e-03 . . . . 1587 1 4 no BMRB 1006 . "insulin A chain" . . . . . 95.24 21 100.00 100.00 1.28e-03 . . . . 1587 1 5 no BMRB 1008 . "insulin A chain" . . . . . 95.24 21 100.00 100.00 1.28e-03 . . . . 1587 1 6 no BMRB 1010 . "insulin A chain" . . . . . 95.24 21 100.00 100.00 1.28e-03 . . . . 1587 1 7 no BMRB 1012 . "insulin A chain" . . . . . 95.24 21 100.00 100.00 1.28e-03 . . . . 1587 1 8 no BMRB 1014 . "insulin A chain" . . . . . 95.24 21 100.00 100.00 1.28e-03 . . . . 1587 1 9 no BMRB 1016 . "insulin A chain" . . . . . 95.24 21 100.00 100.00 1.28e-03 . . . . 1587 1 10 no BMRB 1018 . "insulin A chain" . . . . . 95.24 21 100.00 100.00 1.28e-03 . . . . 1587 1 11 no BMRB 1020 . "insulin A chain" . . . . . 95.24 21 100.00 100.00 1.28e-03 . . . . 1587 1 12 no BMRB 1022 . "insulin A chain" . . . . . 95.24 21 100.00 100.00 1.28e-03 . . . . 1587 1 13 no BMRB 1023 . "insulin B chain" . . . . . 95.24 42 100.00 100.00 1.09e-03 . . . . 1587 1 14 no BMRB 11016 . "Chain A" . . . . . 95.24 21 100.00 100.00 1.28e-03 . . . . 1587 1 15 no BMRB 1344 . "insulin A chain" . . . . . 95.24 21 100.00 100.00 1.28e-03 . . . . 1587 1 16 no BMRB 15464 . "chain A" . . . . . 95.24 21 100.00 100.00 1.28e-03 . . . . 1587 1 17 no BMRB 1585 . "insulin A chain" . . . . . 95.24 21 100.00 100.00 1.48e-03 . . . . 1587 1 18 no BMRB 16026 . INSULIN_A_CHAIN . . . . . 95.24 21 100.00 100.00 1.28e-03 . . . . 1587 1 19 no BMRB 16027 . INSULIN_A_CHAIN . . . . . 95.24 21 100.00 100.00 1.28e-03 . . . . 1587 1 20 no BMRB 1632 . "insulin A chain" . . . . . 95.24 21 100.00 100.00 1.28e-03 . . . . 1587 1 21 no BMRB 16343 . INSULIN_A_CHAIN . . . . . 95.24 21 100.00 100.00 1.28e-03 . . . . 1587 1 22 no BMRB 16608 . Proinsulin . . . . . 95.24 86 100.00 100.00 3.28e-04 . . . . 1587 1 23 no BMRB 16663 . "entity, chain 1" . . . . . 95.24 21 100.00 100.00 1.28e-03 . . . . 1587 1 24 no BMRB 16915 . "entity, chain 1" . . . . . 95.24 22 100.00 100.00 1.11e-03 . . . . 1587 1 25 no BMRB 17107 . entity_1 . . . . . 95.24 21 100.00 100.00 1.28e-03 . . . . 1587 1 26 no BMRB 1761 . "insulin A chain" . . . . . 95.24 21 100.00 100.00 1.28e-03 . . . . 1587 1 27 no BMRB 17803 . "InsulinGR 1" . . . . . 95.24 22 100.00 100.00 1.11e-03 . . . . 1587 1 28 no BMRB 18858 . entity_1 . . . . . 95.24 21 100.00 100.00 1.28e-03 . . . . 1587 1 29 no BMRB 18859 . entity_1 . . . . . 95.24 21 100.00 100.00 1.28e-03 . . . . 1587 1 30 no BMRB 18921 . chain_A . . . . . 95.24 21 100.00 100.00 1.28e-03 . . . . 1587 1 31 no BMRB 18923 . chain_A . . . . . 95.24 21 100.00 100.00 1.28e-03 . . . . 1587 1 32 no BMRB 18924 . chain_A . . . . . 95.24 21 100.00 100.00 1.28e-03 . . . . 1587 1 33 no BMRB 18925 . chain_A . . . . . 95.24 21 100.00 100.00 1.28e-03 . . . . 1587 1 34 no BMRB 19822 . entity_1 . . . . . 95.24 21 100.00 100.00 1.28e-03 . . . . 1587 1 35 no BMRB 19978 . entity_1 . . . . . 95.24 21 100.00 100.00 1.28e-03 . . . . 1587 1 36 no BMRB 19979 . entity . . . . . 95.24 51 100.00 100.00 7.81e-04 . . . . 1587 1 37 no BMRB 25260 . entity_1 . . . . . 95.24 21 100.00 100.00 1.28e-03 . . . . 1587 1 38 no BMRB 25261 . entity_1 . . . . . 95.24 21 100.00 100.00 1.28e-03 . . . . 1587 1 39 no BMRB 4266 . [D-AlaB26]destetra(B27-B30)insulin-B26-amide . . . . . 95.24 47 100.00 100.00 7.57e-04 . . . . 1587 1 40 no PDB 1A7F . "Insulin Mutant B16 Glu, B24 Gly, Des-B30, Nmr, 20 Structures" . . . . . 95.24 21 100.00 100.00 1.28e-03 . . . . 1587 1 41 no PDB 1AI0 . "R6 Human Insulin Hexamer (Non-Symmetric), Nmr, 10 Structures" . . . . . 95.24 21 100.00 100.00 1.28e-03 . . . . 1587 1 42 no PDB 1AIY . "R6 Human Insulin Hexamer (Symmetric), Nmr, 10 Structures" . . . . . 95.24 21 100.00 100.00 1.28e-03 . . . . 1587 1 43 no PDB 1B17 . "Ph Affects Glu B13 Switching And Sulfate Binding In Cubic Insulin Crystals (Ph 5.00 Coordinates)" . . . . . 95.24 21 100.00 100.00 1.28e-03 . . . . 1587 1 44 no PDB 1B18 . "Ph Affects Glu B13 Switching And Sulfate Binding In Cubic Insulin Crystals (Ph 5.53 Coordinates)" . . . . . 95.24 21 100.00 100.00 1.28e-03 . . . . 1587 1 45 no PDB 1B19 . "Ph Affects Glu B13 Switching And Sulfate Binding In Cubic Insulin Crystals (Ph 5.80 Coordinates)" . . . . . 95.24 21 100.00 100.00 1.28e-03 . . . . 1587 1 46 no PDB 1B2A . "Ph Affects Glu B13 Switching And Sulfate Binding In Cubic Insulin Crystals (Ph 6.00 Coordinates)" . . . . . 95.24 21 100.00 100.00 1.28e-03 . . . . 1587 1 47 no PDB 1B2B . "Ph Affects Glu B13 Switching And Sulfate Binding In Cubic Insulin Crystals (Ph 6.16 Coordinates)" . . . . . 95.24 21 100.00 100.00 1.28e-03 . . . . 1587 1 48 no PDB 1B2C . "Ph Affects Glu B13 Switching And Sulfate Binding In Cubic Insulin Crystals (Ph 6.26 Coordinates)" . . . . . 95.24 21 100.00 100.00 1.28e-03 . . . . 1587 1 49 no PDB 1B2D . "Ph Affects Glu B13 Switching And Sulfate Binding In Cubic Insulin Crystals (Ph 6.35 Coordinates)" . . . . . 95.24 21 100.00 100.00 1.28e-03 . . . . 1587 1 50 no PDB 1B2E . "Ph Affects Glu B13 Switching And Sulfate Binding In Cubic Insulin Crystals (Ph 6.50 Coordinates)" . . . . . 95.24 21 100.00 100.00 1.28e-03 . . . . 1587 1 51 no PDB 1B2F . "Ph Affects Glu B13 Switching And Sulfate Binding In Cubic Insulin Crystals (Ph 6.98 Coordinates)" . . . . . 95.24 21 100.00 100.00 1.28e-03 . . . . 1587 1 52 no PDB 1B2G . "Ph Affects Glu B13 Switching And Sulfate Binding In Cubic Insulin Crystals (Ph 9.00 Coordinates)" . . . . . 95.24 21 100.00 100.00 1.28e-03 . . . . 1587 1 53 no PDB 1B9E . "Human Insulin Mutant Serb9glu" . . . . . 95.24 21 100.00 100.00 1.28e-03 . . . . 1587 1 54 no PDB 1BEN . "Insulin Complexed With 4-Hydroxybenzamide" . . . . . 95.24 21 100.00 100.00 1.48e-03 . . . . 1587 1 55 no PDB 1BZV . "[d-Alab26]-Des(B27-B30)-Insulin-B26-Amide A Superpotent Single-Replacement Insulin Analogue, Nmr, Minimized Average Structure" . . . . . 95.24 21 100.00 100.00 1.28e-03 . . . . 1587 1 56 no PDB 1DEI . "Desheptapeptide (B24-B30) Insulin" . . . . . 95.24 21 100.00 100.00 1.28e-03 . . . . 1587 1 57 no PDB 1EFE . "An Active Mini-Proinsulin, M2pi" . . . . . 95.24 60 100.00 100.00 5.90e-04 . . . . 1587 1 58 no PDB 1EV3 . "Structure Of The Rhombohedral Form Of The M-cresol/insulin R6 Hexamer" . . . . . 95.24 21 100.00 100.00 1.28e-03 . . . . 1587 1 59 no PDB 1EV6 . "Structure Of The Monoclinic Form Of The M-CresolINSULIN R6 Hexamer" . . . . . 95.24 21 100.00 100.00 1.28e-03 . . . . 1587 1 60 no PDB 1EVR . "The Structure Of The ResorcinolINSULIN R6 HEXAMER" . . . . . 95.24 21 100.00 100.00 1.28e-03 . . . . 1587 1 61 no PDB 1FU2 . "First Protein Structure Determined From X-Ray Powder Diffraction Data" . . . . . 95.24 21 100.00 100.00 1.28e-03 . . . . 1587 1 62 no PDB 1FUB . "First Protein Structure Determined From X-Ray Powder Diffraction Data" . . . . . 95.24 21 100.00 100.00 1.28e-03 . . . . 1587 1 63 no PDB 1G7A . "1.2 A Structure Of T3r3 Human Insulin At 100 K" . . . . . 95.24 21 100.00 100.00 1.28e-03 . . . . 1587 1 64 no PDB 1G7B . "1.3 A Structure Of T3r3 Human Insulin At 100 K" . . . . . 95.24 21 100.00 100.00 1.28e-03 . . . . 1587 1 65 no PDB 1GUJ . "Insulin At Ph 2: Structural Analysis Of The Conditions Promoting Insulin Fibre Formation." . . . . . 95.24 21 100.00 100.00 1.28e-03 . . . . 1587 1 66 no PDB 1HIQ . "Paradoxical Structure And Function In A Mutant Human Insulin Associated With Diabetes Mellitus" . . . . . 95.24 21 100.00 100.00 1.28e-03 . . . . 1587 1 67 no PDB 1HIS . "Structure And Dynamics Of Des-Pentapeptide-Insulin In Solution: The Molten-Globule Hypothesis." . . . . . 95.24 21 100.00 100.00 1.28e-03 . . . . 1587 1 68 no PDB 1HIT . "Receptor Binding Redefined By A Structural Switch In A Mutant Human Insulin" . . . . . 95.24 21 100.00 100.00 1.28e-03 . . . . 1587 1 69 no PDB 1HLS . "Nmr Structure Of The Human Insulin-His(B16)" . . . . . 95.24 21 100.00 100.00 1.28e-03 . . . . 1587 1 70 no PDB 1HTV . "Crystal Structure Of Destripeptide (B28-B30) Insulin" . . . . . 95.24 21 100.00 100.00 1.28e-03 . . . . 1587 1 71 no PDB 1HUI . "Insulin Mutant (B1, B10, B16, B27)glu, Des-B30, Nmr, 25 Structures" . . . . . 95.24 21 100.00 100.00 1.28e-03 . . . . 1587 1 72 no PDB 1IZA . "Role Of B13 Glu In Insulin Assembly: The Hexamer Structure Of Recombinant Mutant (B13 Glu-> Gln) Insulin" . . . . . 95.24 21 100.00 100.00 1.28e-03 . . . . 1587 1 73 no PDB 1IZB . "Role Of B13 Glu In Insulin Assembly: The Hexamer Structure Of Recombinant Mutant (B13 Glu-> Gln) Insulin" . . . . . 95.24 21 100.00 100.00 1.28e-03 . . . . 1587 1 74 no PDB 1JCO . "Solution Structure Of The Monomeric [thr(B27)->pro,Pro(B28)- >thr] Insulin Mutant (Pt Insulin)" . . . . . 95.24 21 100.00 100.00 1.28e-03 . . . . 1587 1 75 no PDB 1K3M . "Nmr Structure Of Human Insulin Mutant Ile-A2-Ala, His-B10- Asp, Pro-B28-Lys, Lys-B29-Pro, 15 Structures" . . . . . 90.48 21 100.00 100.00 4.31e-03 . . . . 1587 1 76 no PDB 1KMF . "Nmr Structure Of Human Insulin Mutant Ile-A2-Allo-Ile, His- B10-Asp, Pro-B28-Lys, Lys-B29-Pro, 15 Structures" . . . . . 90.48 21 100.00 100.00 5.42e-03 . . . . 1587 1 77 no PDB 1LKQ . "Nmr Structure Of Human Insulin Mutant Ile-A2-Gly, Val-A3- Gly, His-B10-Asp, Pro-B28-Lys, Lys-B29-Pro, 20 Structures" . . . . . 85.71 21 100.00 100.00 1.74e-02 . . . . 1587 1 78 no PDB 1LPH . "Lys(B28)pro(B29)-Human Insulin" . . . . . 95.24 21 100.00 100.00 1.28e-03 . . . . 1587 1 79 no PDB 1M5A . "Crystal Structure Of 2-Co(2+)-Insulin At 1.2a Resolution" . . . . . 95.24 21 100.00 100.00 1.28e-03 . . . . 1587 1 80 no PDB 1MHI . "Three-Dimensional Solution Structure Of An Insulin Dimer. A Study Of The B9(Asp) Mutant Of Human Insulin Using Nuclear Magnetic" . . . . . 95.24 21 100.00 100.00 1.48e-03 . . . . 1587 1 81 no PDB 1MHJ . "Solution Structure Of The Superactive Monomeric Des- [phe(B25)] Human Insulin Mutant. Elucidation Of The Structural Basis For T" . . . . . 95.24 21 100.00 100.00 1.28e-03 . . . . 1587 1 82 no PDB 1MPJ . "X-Ray Crystallographic Studies On Hexameric Insulins In The Presence Of Helix-Stabilizing Agents, Thiocyanate, Methylparaben An" . . . . . 95.24 21 100.00 100.00 1.28e-03 . . . . 1587 1 83 no PDB 1MSO . "T6 Human Insulin At 1.0 A Resolution" . . . . . 95.24 21 100.00 100.00 1.28e-03 . . . . 1587 1 84 no PDB 1OS3 . "Dehydrated T6 Human Insulin At 100 K" . . . . . 95.24 21 100.00 100.00 1.28e-03 . . . . 1587 1 85 no PDB 1OS4 . "Dehydrated T6 Human Insulin At 295 K" . . . . . 95.24 21 100.00 100.00 1.28e-03 . . . . 1587 1 86 no PDB 1Q4V . "Crystal Structure Of Allo-Ilea2-Insulin, An Inactive Chiral Analogue: Implications For The Mechanism Of Receptor" . . . . . 90.48 21 100.00 100.00 5.42e-03 . . . . 1587 1 87 no PDB 1QIY . "Human Insulin Hexamers With Chain B His Mutated To Tyr Complexed With Phenol" . . . . . 95.24 21 100.00 100.00 1.28e-03 . . . . 1587 1 88 no PDB 1QIZ . "Human Insulin Hexamers With Chain B His Mutated To Tyr Complexed With Resorcinol" . . . . . 95.24 21 100.00 100.00 1.28e-03 . . . . 1587 1 89 no PDB 1QJ0 . "Human Insulin Hexamers With Chain B His Mutated To Tyr" . . . . . 95.24 21 100.00 100.00 1.28e-03 . . . . 1587 1 90 no PDB 1SDB . "Porcine Desb1-2 Despentapeptide(B26-B30) Insulin" . . . . . 95.24 21 100.00 100.00 1.28e-03 . . . . 1587 1 91 no PDB 1SF1 . "Nmr Structure Of Human Insulin Under Amyloidogenic Condition, 15 Structures" . . . . . 95.24 21 100.00 100.00 1.28e-03 . . . . 1587 1 92 no PDB 1SJT . "Mini-Proinsulin, Two Chain Insulin Analog Mutant: Des B30, His(B 10)asp, Pro(B 28)asp, Nmr, 20 Structures" . . . . . 95.24 21 100.00 100.00 1.28e-03 . . . . 1587 1 93 no PDB 1SJU . "Mini-Proinsulin, Single Chain Insulin Analog Mutant: Des B30, His(B 10)asp, Pro(B 28)asp And Peptide Bond Between Lys B 29 And " . . . . . 95.24 50 100.00 100.00 8.22e-04 . . . . 1587 1 94 no PDB 1T1K . "Nmr Structure Of Human Insulin Mutant His-B10-Asp, Val-B12- Ala, Pro-B28-Lys, Lys-B29-Pro, 15 Structures" . . . . . 95.24 21 100.00 100.00 1.28e-03 . . . . 1587 1 95 no PDB 1T1P . "Nmr Structure Of Human Insulin Mutant His-B10-Asp, Val-B12- Thr, Pro-B28-Lys, Lys-B29-Pro, 15 Structures" . . . . . 95.24 21 100.00 100.00 1.28e-03 . . . . 1587 1 96 no PDB 1T1Q . "Nmr Structure Of Human Insulin Mutant His-B10-Asp, Val-B12-Aba, Pro- B28-Lys, Lys-B29-Pro, 15 Structures" . . . . . 95.24 21 100.00 100.00 1.28e-03 . . . . 1587 1 97 no PDB 1TRZ . "Crystallographic Evidence For Dual Coordination Around Zinc In The T3r3 Human Insulin Hexamer" . . . . . 95.24 21 100.00 100.00 1.28e-03 . . . . 1587 1 98 no PDB 1TYL . "The Structure Of A Complex Of Hexameric Insulin And 4'- Hydroxyacetanilide" . . . . . 95.24 21 100.00 100.00 1.28e-03 . . . . 1587 1 99 no PDB 1TYM . "The Structure Of A Complex Of Hexameric Insulin And 4'- Hydroxyacetanilide" . . . . . 95.24 21 100.00 100.00 1.28e-03 . . . . 1587 1 100 no PDB 1UZ9 . "Crystallographic And Solution Studies Of N-Lithocholyl Insulin: A New Generation Of Prolonged-Acting Insulins." . . . . . 95.24 21 100.00 100.00 1.28e-03 . . . . 1587 1 101 no PDB 1W8P . "Structural Properties Of The B25tyr-Nme-B26phe Insulin Mutant." . . . . . 95.24 21 100.00 100.00 1.28e-03 . . . . 1587 1 102 no PDB 1WAV . "Crystal Structure Of Form B Monoclinic Crystal Of Insulin" . . . . . 95.24 21 100.00 100.00 1.28e-03 . . . . 1587 1 103 no PDB 1XDA . "Structure Of Insulin" . . . . . 95.24 21 100.00 100.00 1.28e-03 . . . . 1587 1 104 no PDB 1XGL . "Human Insulin Disulfide Isomer, Nmr, 10 Structures" . . . . . 95.24 21 100.00 100.00 1.28e-03 . . . . 1587 1 105 no PDB 1ZEG . "Structure Of B28 Asp Insulin In Complex With Phenol" . . . . . 95.24 21 100.00 100.00 1.28e-03 . . . . 1587 1 106 no PDB 1ZEH . "Structure Of Insulin" . . . . . 95.24 21 100.00 100.00 1.28e-03 . . . . 1587 1 107 no PDB 1ZEI . "Cross-Linked B28 Asp Insulin" . . . . . 95.24 53 100.00 100.00 6.42e-04 . . . . 1587 1 108 no PDB 1ZNI . Insulin . . . . . 95.24 21 100.00 100.00 1.28e-03 . . . . 1587 1 109 no PDB 1ZNJ . "Insulin, Monoclinic Crystal Form" . . . . . 95.24 21 100.00 100.00 1.28e-03 . . . . 1587 1 110 no PDB 2AIY . "R6 Human Insulin Hexamer (Symmetric), Nmr, 20 Structures" . . . . . 95.24 21 100.00 100.00 1.28e-03 . . . . 1587 1 111 no PDB 2C8Q . "Insuline(1sec) And Uv Laser Excited Fluorescence" . . . . . 95.24 21 100.00 100.00 1.28e-03 . . . . 1587 1 112 no PDB 2C8R . "Insuline(60sec) And Uv Laser Excited Fluorescence" . . . . . 95.24 21 100.00 100.00 1.28e-03 . . . . 1587 1 113 no PDB 2CEU . "Despentapeptide Insulin In Acetic Acid (Ph 2)" . . . . . 95.24 21 100.00 100.00 1.28e-03 . . . . 1587 1 114 no PDB 2EFA . "Neutron Crystal Structure Of Cubic Insulin At Pd6.6" . . . . . 95.24 21 100.00 100.00 1.28e-03 . . . . 1587 1 115 no PDB 2G4M . "Insulin Collected At 2.0 A Wavelength" . . . . . 95.24 21 100.00 100.00 1.28e-03 . . . . 1587 1 116 no PDB 2H67 . "Nmr Structure Of Human Insulin Mutant His-B5-Ala, His-B10- Asp Pro-B28-Lys, Lys-B29-Pro, 20 Structures" . . . . . 95.24 21 100.00 100.00 1.28e-03 . . . . 1587 1 117 no PDB 2HH4 . "Nmr Structure Of Human Insulin Mutant Gly-B8-D-Ser, His-B10- Asp Pro-B28-Lys, Lys-B29-Pro, 20 Structures" . . . . . 95.24 21 100.00 100.00 1.28e-03 . . . . 1587 1 118 no PDB 2HHO . "Nmr Structure Of Human Insulin Mutant Gly-B8-Ser, His-B10- Asp Pro-B28-Lys, Lys-B29-Pro, 20 Structures" . . . . . 95.24 21 100.00 100.00 1.28e-03 . . . . 1587 1 119 no PDB 2HIU . "Nmr Structure Of Human Insulin In 20% Acetic Acid, Zinc- Free, 10 Structures" . . . . . 95.24 21 100.00 100.00 1.28e-03 . . . . 1587 1 120 no PDB 2JMN . "Nmr Structure Of Human Insulin Mutant His-B10-Asp, Pro-B28- Lys, Lys-B29-Pro, 20 Structures" . . . . . 95.24 21 100.00 100.00 1.28e-03 . . . . 1587 1 121 no PDB 2JV1 . "Nmr Structure Of Human Insulin Monomer In 35% Cd3cn Zinc Free, 50 Structures" . . . . . 95.24 21 100.00 100.00 1.28e-03 . . . . 1587 1 122 no PDB 2K91 . "Enhancing The Activity Of Insulin By Stereospecific Unfolding" . . . . . 95.24 21 100.00 100.00 1.28e-03 . . . . 1587 1 123 no PDB 2K9R . "Enhancing The Activity Of Insulin By Stereospecific Unfolding" . . . . . 95.24 21 100.00 100.00 1.28e-03 . . . . 1587 1 124 no PDB 2KJJ . "Dynamics Of Insulin Probed By 1h-Nmr Amide Proton Exchange A Flexibility Of The Receptor-Binding Surface" . . . . . 95.24 21 100.00 100.00 1.28e-03 . . . . 1587 1 125 no PDB 2KJU . "Nmr Structure Of Human Insulin Mutant Glu-B21-D-Glu, His-B10 B28-Lys, Lys-B29-Pro, 20 Structures" . . . . . 95.24 21 100.00 100.00 1.28e-03 . . . . 1587 1 126 no PDB 2KQP . "Nmr Structure Of Proinsulin" . . . . . 95.24 86 100.00 100.00 3.28e-04 . . . . 1587 1 127 no PDB 2KQQ . "Nmr Structure Of Human Insulin Mutant Gly-B8-D-Ala, His-B10-Asp, Pro- B28-Lys, Lys-B29-Pro, 20 Structures" . . . . . 95.24 21 100.00 100.00 1.28e-03 . . . . 1587 1 128 no PDB 2KXK . "Human Insulin Mutant A22gly-B31lys-B32arg" . . . . . 95.24 22 100.00 100.00 1.11e-03 . . . . 1587 1 129 no PDB 2L1Y . "Nmr Structure Of Human Insulin Mutant Gly-B20-D-Ala, Gly-B23-D-Ala Pro-B28-Lys, Lys-B29-Pro, 20 Structures" . . . . . 95.24 21 100.00 100.00 1.28e-03 . . . . 1587 1 130 no PDB 2LGB . "Modified A22gly-B31arg Human Insulin" . . . . . 95.24 22 100.00 100.00 1.11e-03 . . . . 1587 1 131 no PDB 2M1D . "Biosynthetic Engineered B28k-b29p Human Insulin Monomer Structure In In Water/acetonitrile Solutions." . . . . . 95.24 21 100.00 100.00 1.28e-03 . . . . 1587 1 132 no PDB 2M1E . "Biosynthetic Engineered B28k-b29p Human Insulin Monomer Structure In In Water Solutions." . . . . . 95.24 21 100.00 100.00 1.28e-03 . . . . 1587 1 133 no PDB 2M2M . "Structure Of [l-hisb24] Insulin Analogue At Ph 1.9" . . . . . 95.24 21 100.00 100.00 1.28e-03 . . . . 1587 1 134 no PDB 2M2N . "Structure Of [l-hisb24] Insulin Analogue At Ph 8.0" . . . . . 95.24 21 100.00 100.00 1.28e-03 . . . . 1587 1 135 no PDB 2M2O . "Structure Of [d-hisb24] Insulin Analogue At Ph 1.9" . . . . . 95.24 21 100.00 100.00 1.28e-03 . . . . 1587 1 136 no PDB 2M2P . "Structure Of [d-hisb24] Insulin Analogue At Ph 8.0" . . . . . 95.24 21 100.00 100.00 1.28e-03 . . . . 1587 1 137 no PDB 2MLI . "Nmr Structure Of B25-(alpha, Beta)-dehydro-phenylalanine Insulin" . . . . . 95.24 21 100.00 100.00 1.28e-03 . . . . 1587 1 138 no PDB 2MPG . "Solution Structure Of The [aibb8,lysb28,prob29]-insulin Analogue" . . . . . 95.24 21 100.00 100.00 1.28e-03 . . . . 1587 1 139 no PDB 2MVC . "Solution Structure Of Human Insulin At Ph 1.9" . . . . . 95.24 21 100.00 100.00 1.28e-03 . . . . 1587 1 140 no PDB 2MVD . "Solution Structure Of [glnb22]-insulin Mutant At Ph 1.9" . . . . . 95.24 21 100.00 100.00 1.28e-03 . . . . 1587 1 141 no PDB 2OLY . "Structure Of Human Insulin In Presence Of Urea At Ph 7.0" . . . . . 95.24 21 100.00 100.00 1.28e-03 . . . . 1587 1 142 no PDB 2OLZ . "Structure Of Human Insulin In Presence Of Thiocyanate At Ph 7.0" . . . . . 95.24 21 100.00 100.00 1.28e-03 . . . . 1587 1 143 no PDB 2OM0 . "Structure Of Human Insulin In Presence Of Urea At Ph 6.5" . . . . . 95.24 21 100.00 100.00 1.28e-03 . . . . 1587 1 144 no PDB 2OM1 . "Structure Of Human Insulin In Presence Of Thiocyanate At Ph 6.5" . . . . . 95.24 21 100.00 100.00 1.28e-03 . . . . 1587 1 145 no PDB 2OMG . "Structure Of Human Insulin Cocrystallized With Protamine And Urea" . . . . . 95.24 21 100.00 100.00 1.28e-03 . . . . 1587 1 146 no PDB 2OMH . "Structure Of Human Insulin Cocrystallized With Arg-12 Peptide In Presence Of Urea" . . . . . 95.24 21 100.00 100.00 1.28e-03 . . . . 1587 1 147 no PDB 2OMI . "Structure Of Human Insulin Cocrystallized With Protamine" . . . . . 95.24 21 100.00 100.00 1.28e-03 . . . . 1587 1 148 no PDB 2QIU . "Structure Of Human Arg-Insulin" . . . . . 95.24 22 100.00 100.00 1.13e-03 . . . . 1587 1 149 no PDB 2R34 . "Crystal Structure Of Mn Human Arg-Insulin" . . . . . 95.24 22 100.00 100.00 1.13e-03 . . . . 1587 1 150 no PDB 2R35 . "Crystal Structure Of Rb Human Arg-Insulin" . . . . . 95.24 22 100.00 100.00 1.13e-03 . . . . 1587 1 151 no PDB 2R36 . "Crystal Structure Of Ni Human Arg-Insulin" . . . . . 95.24 22 100.00 100.00 1.13e-03 . . . . 1587 1 152 no PDB 2RN5 . "Humal Insulin Mutant B31lys-B32arg" . . . . . 95.24 21 100.00 100.00 1.28e-03 . . . . 1587 1 153 no PDB 2TCI . "X-Ray Crystallographic Studies On Hexameric Insulins In The Presence Of Helix-Stabilizing Agents, Thiocyanate, Methylparaben An" . . . . . 95.24 21 100.00 100.00 1.28e-03 . . . . 1587 1 154 no PDB 2VJZ . "Crystal Structure Form Ultalente Insulin Microcrystals" . . . . . 95.24 21 100.00 100.00 1.28e-03 . . . . 1587 1 155 no PDB 2VK0 . "Crystal Structure Form Ultalente Insulin Microcrystals" . . . . . 95.24 21 100.00 100.00 1.28e-03 . . . . 1587 1 156 no PDB 2W44 . "Structure Deltaa1-a4 Insulin" . . . . . 80.95 17 100.00 100.00 1.33e-01 . . . . 1587 1 157 no PDB 2WBY . "Crystal Structure Of Human Insulin-Degrading Enzyme In Complex With Insulin" . . . . . 90.48 20 100.00 100.00 7.95e-03 . . . . 1587 1 158 no PDB 2WC0 . "Crystal Structure Of Human Insulin Degrading Enzyme In Complex With Iodinated Insulin" . . . . . 95.24 21 100.00 100.00 1.28e-03 . . . . 1587 1 159 no PDB 2WRU . "Semi-synthetic Highly Active Analogue Of Human Insulin Nmealab26-dti-nh2" . . . . . 95.24 21 100.00 100.00 1.28e-03 . . . . 1587 1 160 no PDB 2WRV . "Semi-Synthetic Highly Active Analogue Of Human Insulin Nmehisb26-Dti-Nh2" . . . . . 95.24 21 100.00 100.00 1.28e-03 . . . . 1587 1 161 no PDB 2WRW . "Semi-Synthetic Highly Active Analogue Of Human Insulin D- Prob26-Dti-Nh2" . . . . . 95.24 21 100.00 100.00 1.28e-03 . . . . 1587 1 162 no PDB 2WRX . "Semi-Synthetic Analogue Of Human Insulin Nmealab26-Insulin At Ph 3.0" . . . . . 95.24 21 100.00 100.00 1.28e-03 . . . . 1587 1 163 no PDB 2WS0 . "Semi-Synthetic Analogue Of Human Insulin Nmealab26-Insulin At Ph 7.5" . . . . . 95.24 21 100.00 100.00 1.28e-03 . . . . 1587 1 164 no PDB 2WS1 . "Semi-Synthetic Analogue Of Human Insulin Nmetyrb26-Insulin In Monomer Form" . . . . . 95.24 21 100.00 100.00 1.28e-03 . . . . 1587 1 165 no PDB 2WS4 . "Semi-Synthetic Analogue Of Human Insulin Prob26-Dti In Monomer Form" . . . . . 95.24 21 100.00 100.00 1.28e-03 . . . . 1587 1 166 no PDB 2WS6 . "Semi-Synthetic Analogue Of Human Insulin Nmetyrb26-Insulin In Hexamer Form" . . . . . 95.24 21 100.00 100.00 1.28e-03 . . . . 1587 1 167 no PDB 2WS7 . "Semi-Synthetic Analogue Of Human Insulin Prob26-Dti" . . . . . 95.24 21 100.00 100.00 1.28e-03 . . . . 1587 1 168 no PDB 2ZPP . "Neutron Crystal Structure Of Cubic Insulin At Pd9" . . . . . 95.24 21 100.00 100.00 1.28e-03 . . . . 1587 1 169 no PDB 3AIY . "R6 Human Insulin Hexamer (Symmetric), Nmr, Refined Average Structure" . . . . . 95.24 21 100.00 100.00 1.28e-03 . . . . 1587 1 170 no PDB 3BXQ . "The Structure Of A Mutant Insulin Uncouples Receptor Binding From Protein Allostery. An Electrostatic Block To The Tr Transitio" . . . . . 95.24 21 100.00 100.00 1.28e-03 . . . . 1587 1 171 no PDB 3E7Y . "Structure Of Human Insulin" . . . . . 95.24 21 100.00 100.00 1.28e-03 . . . . 1587 1 172 no PDB 3E7Z . "Structure Of Human Insulin" . . . . . 95.24 21 100.00 100.00 1.28e-03 . . . . 1587 1 173 no PDB 3EXX . "Structure Of The T6 Human Insulin Derivative With Nickel At 1.35 A Resolution" . . . . . 95.24 21 100.00 100.00 1.28e-03 . . . . 1587 1 174 no PDB 3FHP . "A Neutron Crystallographic Analysis Of A Porcine 2zn Insulin At 2.0 A Resolution" . . . . . 95.24 21 100.00 100.00 1.28e-03 . . . . 1587 1 175 no PDB 3I3Z . "Human Insulin" . . . . . 95.24 21 100.00 100.00 1.28e-03 . . . . 1587 1 176 no PDB 3I40 . "Human Insulin" . . . . . 95.24 21 100.00 100.00 1.28e-03 . . . . 1587 1 177 no PDB 3ILG . "Crystal Structure Of Humnan Insulin Sr+2 Complex" . . . . . 95.24 21 100.00 100.00 1.28e-03 . . . . 1587 1 178 no PDB 3INC . "Crystal Structure Of Human Insulin With Ni+2 Complex" . . . . . 95.24 21 100.00 100.00 1.28e-03 . . . . 1587 1 179 no PDB 3INS . "Structure Of Insulin. Results Of Joint Neutron And X-ray Refinement" . . . . . 95.24 21 100.00 100.00 1.28e-03 . . . . 1587 1 180 no PDB 3IR0 . "Crystal Structure Of Human Insulin Complexed With Cu+2 Metal Ion" . . . . . 95.24 21 100.00 100.00 1.28e-03 . . . . 1587 1 181 no PDB 3JSD . "Insulin's Biosynthesis And Activity Have Opposing Structural Requirements: A New Factor In Neonatal Diabetes Mellitus" . . . . . 95.24 21 100.00 100.00 1.28e-03 . . . . 1587 1 182 no PDB 3MTH . "X-Ray Crystallographic Studies On Hexameric Insulins In The Presence Of Helix-Stabilizing Agents, Thiocyanate, Methylparaben An" . . . . . 95.24 21 100.00 100.00 1.28e-03 . . . . 1587 1 183 no PDB 3P2X . "Insulin Fibrillation Is The Janus Face Of Induced Fit. A Chiaral Clamp Stabilizes The Native State At The Expense Of Activity" . . . . . 95.24 21 100.00 100.00 1.28e-03 . . . . 1587 1 184 no PDB 3P33 . "Insulin Fibrillation Is The Janus Face Of Induced Fit. A Chiral Clamp Stabilizes The Native State At The Expense Of Activity" . . . . . 95.24 21 100.00 100.00 1.28e-03 . . . . 1587 1 185 no PDB 3Q6E . "Human Insulin In Complex With Cucurbit[7]uril" . . . . . 95.24 21 100.00 100.00 1.28e-03 . . . . 1587 1 186 no PDB 3ROV . "Insulin's Biosynthesis And Activity Have Opposing Structural Requirements: A New Factor In Neonatal Diabetes Mellitus" . . . . . 95.24 21 100.00 100.00 1.28e-03 . . . . 1587 1 187 no PDB 3RTO . "Acoustically Mounted Porcine Insulin Microcrystals Yield An X-Ray Sad Structure" . . . . . 95.24 21 100.00 100.00 1.28e-03 . . . . 1587 1 188 no PDB 3T2A . "Tmao-Grown Cubic Insulin (Porcine)" . . . . . 95.24 21 100.00 100.00 1.28e-03 . . . . 1587 1 189 no PDB 3TT8 . "Crystal Structure Analysis Of Cu Human Insulin Derivative" . . . . . 95.24 21 100.00 100.00 1.28e-03 . . . . 1587 1 190 no PDB 3U4N . "A Novel Covalently Linked Insulin Dimer" . . . . . 95.24 21 100.00 100.00 1.28e-03 . . . . 1587 1 191 no PDB 3V1G . "Forestalling Insulin Fibrillation By Insertion Of A Chiral Clamp Mechanism-Based Application Of Protein Engineering To Global H" . . . . . 95.24 21 100.00 100.00 1.28e-03 . . . . 1587 1 192 no PDB 3W11 . "Insulin Receptor Ectodomain Construct Comprising Domains L1-cr In Complex With Human Insulin, Alpha-ct Peptide(704-719) And Fab" . . . . . 95.24 21 100.00 100.00 1.28e-03 . . . . 1587 1 193 no PDB 3W12 . "Insulin Receptor Ectodomain Construct Comprising Domains L1-cr In Complex With High-affinity Insulin Analogue [d-pro-b26]-dti-n" . . . . . 95.24 21 100.00 100.00 1.28e-03 . . . . 1587 1 194 no PDB 3W13 . "Insulin Receptor Ectodomain Construct Comprising Domains L1-cr In Complex With High-affinity Insulin Analogue [d-pro-b26]-dti-n" . . . . . 95.24 21 100.00 100.00 1.28e-03 . . . . 1587 1 195 no PDB 3W7Y . "0.92a Structure Of 2zn Human Insulin At 100k" . . . . . 95.24 21 100.00 100.00 1.28e-03 . . . . 1587 1 196 no PDB 3W7Z . "1.15a Structure Of Human 2zn Insulin At 293k" . . . . . 95.24 21 100.00 100.00 1.28e-03 . . . . 1587 1 197 no PDB 3W80 . "Crystal Structure Of Dodecamer Human Insulin With Double C-axis Length Of The Hexamer 2 Zn Insulin Cell" . . . . . 95.24 21 100.00 100.00 1.28e-03 . . . . 1587 1 198 no PDB 3ZI3 . "Crystal Structure Of The B24his-insulin - Human Analogue" . . . . . 95.24 21 100.00 100.00 1.28e-03 . . . . 1587 1 199 no PDB 3ZQR . "Nmepheb25 Insulin Analogue Crystal Structure" . . . . . 95.24 21 100.00 100.00 1.28e-03 . . . . 1587 1 200 no PDB 3ZS2 . "Tyrb25,Nmepheb26,Lysb28,Prob29-Insulin Analogue Crystal Structure" . . . . . 95.24 21 100.00 100.00 1.28e-03 . . . . 1587 1 201 no PDB 3ZU1 . "Structure Of Lysb29(Nepsilon Omega-Carboxyheptadecanoyl) Des(B30) Human Insulin" . . . . . 95.24 21 100.00 100.00 1.28e-03 . . . . 1587 1 202 no PDB 4A7E . "X-Ray Crystal Structure Of Porcine Insulin Flash-Cooled At High Pressure" . . . . . 95.24 21 100.00 100.00 1.28e-03 . . . . 1587 1 203 no PDB 4AIY . "R6 Human Insulin Hexamer (Symmetric), Nmr, 'green' Substate, Average Structure" . . . . . 95.24 21 100.00 100.00 1.28e-03 . . . . 1587 1 204 no PDB 4AJX . "Ligand Controlled Assembly Of Hexamers, Dihexamers, And Linear Multihexamer Structures By An Engineered Acylated Insulin" . . . . . 95.24 21 100.00 100.00 1.28e-03 . . . . 1587 1 205 no PDB 4AJZ . "Ligand Controlled Assembly Of Hexamers, Dihexamers, And Linear Multihexamer Structures By An Engineered Acylated Insulin" . . . . . 95.24 21 100.00 100.00 1.28e-03 . . . . 1587 1 206 no PDB 4AK0 . "Ligand Controlled Assembly Of Hexamers, Dihexamers, And Linear Multihexamer Structures By An Engineered Acylated Insulin" . . . . . 95.24 21 100.00 100.00 1.28e-03 . . . . 1587 1 207 no PDB 4AKJ . "Ligand Controlled Assembly Of Hexamers, Dihexamers, And Linear Multihexamer Structures By An Engineered Acylated Insulin" . . . . . 95.24 21 100.00 100.00 1.28e-03 . . . . 1587 1 208 no PDB 4CXL . "Human Insulin Analogue (d-prob8)-insulin" . . . . . 95.24 21 100.00 100.00 1.28e-03 . . . . 1587 1 209 no PDB 4CXN . "Crystal Structure Of Human Insulin Analogue (nme-alab8)- Insulin Crystal Form I" . . . . . 95.24 21 100.00 100.00 1.28e-03 . . . . 1587 1 210 no PDB 4CY7 . "Crystal Structure Of Human Insulin Analogue (nme-alab8)- Insulin Crystal Form Ii" . . . . . 95.24 21 100.00 100.00 1.28e-03 . . . . 1587 1 211 no PDB 4EWW . "Human Insulin" . . . . . 95.24 21 100.00 100.00 1.28e-03 . . . . 1587 1 212 no PDB 4EWX . "Human Insulin" . . . . . 95.24 21 100.00 100.00 1.28e-03 . . . . 1587 1 213 no PDB 4EWZ . "Human Insulin" . . . . . 95.24 21 100.00 100.00 1.28e-03 . . . . 1587 1 214 no PDB 4EX0 . "Human Insulin" . . . . . 95.24 21 100.00 100.00 1.28e-03 . . . . 1587 1 215 no PDB 4EX1 . "Human Insulin" . . . . . 95.24 21 100.00 100.00 1.28e-03 . . . . 1587 1 216 no PDB 4EXX . "Human Insulin" . . . . . 95.24 21 100.00 100.00 1.28e-03 . . . . 1587 1 217 no PDB 4EY1 . "Human Insulin" . . . . . 95.24 21 100.00 100.00 1.28e-03 . . . . 1587 1 218 no PDB 4EY9 . "Human Insulin" . . . . . 95.24 21 100.00 100.00 1.28e-03 . . . . 1587 1 219 no PDB 4EYD . "Human Insulin" . . . . . 95.24 21 100.00 100.00 1.28e-03 . . . . 1587 1 220 no PDB 4EYN . "Human Insulin" . . . . . 95.24 21 100.00 100.00 1.28e-03 . . . . 1587 1 221 no PDB 4EYP . "Human Insulin" . . . . . 95.24 21 100.00 100.00 1.28e-03 . . . . 1587 1 222 no PDB 4F0N . "Human Insulin" . . . . . 95.24 21 100.00 100.00 1.28e-03 . . . . 1587 1 223 no PDB 4F0O . "Human Insulin" . . . . . 95.24 21 100.00 100.00 1.28e-03 . . . . 1587 1 224 no PDB 4F1A . "Human Insulin" . . . . . 95.24 21 100.00 100.00 1.28e-03 . . . . 1587 1 225 no PDB 4F1B . "Human Insulin" . . . . . 95.24 21 100.00 100.00 1.28e-03 . . . . 1587 1 226 no PDB 4F1C . "Human Insulin" . . . . . 95.24 21 100.00 100.00 1.28e-03 . . . . 1587 1 227 no PDB 4F1D . "Human Insulin" . . . . . 95.24 21 100.00 100.00 1.28e-03 . . . . 1587 1 228 no PDB 4F1F . "Human Insulin" . . . . . 95.24 21 100.00 100.00 1.28e-03 . . . . 1587 1 229 no PDB 4F1G . "Human Insulin" . . . . . 95.24 21 100.00 100.00 1.28e-03 . . . . 1587 1 230 no PDB 4F4T . "Human Insulin" . . . . . 95.24 21 100.00 100.00 1.28e-03 . . . . 1587 1 231 no PDB 4F4V . "Human Insulin" . . . . . 95.24 21 100.00 100.00 1.28e-03 . . . . 1587 1 232 no PDB 4F51 . "Human Insulin" . . . . . 95.24 21 100.00 100.00 1.28e-03 . . . . 1587 1 233 no PDB 4F8F . "Human Insulin" . . . . . 95.24 21 100.00 100.00 1.28e-03 . . . . 1587 1 234 no PDB 4FG3 . "Crystal Structure Analysis Of The Human Insulin" . . . . . 95.24 21 100.00 100.00 1.28e-03 . . . . 1587 1 235 no PDB 4FKA . "High Resolution Structure Of The Manganese Derivative Of Insulin" . . . . . 95.24 21 100.00 100.00 1.28e-03 . . . . 1587 1 236 no PDB 4GBC . "Crystal Structure Of Aspart Insulin At Ph 6.5" . . . . . 95.24 21 100.00 100.00 1.28e-03 . . . . 1587 1 237 no PDB 4GBI . "Crystal Structure Of Aspart Insulin At Ph 6.5" . . . . . 95.24 21 100.00 100.00 1.28e-03 . . . . 1587 1 238 no PDB 4GBK . "Crystal Structure Of Aspart Insulin At Ph 8.5" . . . . . 95.24 21 100.00 100.00 1.28e-03 . . . . 1587 1 239 no PDB 4GBL . "Crystal Structure Of Aspart Insulin At Ph 8.5" . . . . . 95.24 21 100.00 100.00 1.28e-03 . . . . 1587 1 240 no PDB 4GBN . "Crystal Structure Of Aspart Insulin At Ph 6.5" . . . . . 95.24 21 100.00 100.00 1.28e-03 . . . . 1587 1 241 no PDB 4INS . "The Structure Of 2zn Pig Insulin Crystals At 1.5 Angstroms Resolution" . . . . . 95.24 21 100.00 100.00 1.28e-03 . . . . 1587 1 242 no PDB 4IUZ . "High Resolution Crystal Structure Of Racemic Ester Insulin" . . . . . 95.24 21 100.00 100.00 1.28e-03 . . . . 1587 1 243 no PDB 4NIB . "Crystal Structure Of Human Insulin Mutant B20 D-ala, B23 D-ala" . . . . . 95.24 21 100.00 100.00 1.28e-03 . . . . 1587 1 244 no PDB 4OGA . "Insulin In Complex With Site 1 Of The Human Insulin Receptor" . . . . . 95.24 21 100.00 100.00 1.28e-03 . . . . 1587 1 245 no PDB 4P65 . "Crystal Structure Of An Cyclohexylalanine Substituted Insulin Analog." . . . . . 95.24 21 100.00 100.00 1.28e-03 . . . . 1587 1 246 no PDB 4Q5Z . "Crystal Structure Analysis Of Fab-bound Human Insulin Degrading Enzyme (ide) In Complex With Insulin" . . . . . 90.48 20 100.00 100.00 7.95e-03 . . . . 1587 1 247 no PDB 4RXW . "Crystal Structure Of The Cobalt Human Insulin Derivative" . . . . . 95.24 21 100.00 100.00 1.28e-03 . . . . 1587 1 248 no PDB 4UNE . "Human Insulin B26phe Mutant Crystal Structure" . . . . . 95.24 21 100.00 100.00 1.28e-03 . . . . 1587 1 249 no PDB 4UNG . "Human Insulin B26asn Mutant Crystal Structure" . . . . . 95.24 21 100.00 100.00 1.28e-03 . . . . 1587 1 250 no PDB 4UNH . "Human Insulin B26gly Mutant Crystal Structure" . . . . . 95.24 21 100.00 100.00 1.28e-03 . . . . 1587 1 251 no PDB 4XC4 . "Insulin Co-crystallizes In The Presence Of It Beta-cell Chaperone Sulfatide" . . . . . 95.24 21 100.00 100.00 1.28e-03 . . . . 1587 1 252 no PDB 5AIY . "R6 Human Insulin Hexamer (Symmetric), Nmr, 'red' Substate, Average Structure" . . . . . 95.24 21 100.00 100.00 1.28e-03 . . . . 1587 1 253 no PDB 5CNY . "Crystal Structure Of Human Zinc Insulin At Ph 5.5" . . . . . 95.24 21 100.00 100.00 1.28e-03 . . . . 1587 1 254 no PDB 5CO2 . "Crystalization Of Human Zinc Insulin At Ph 5.5" . . . . . 95.24 21 100.00 100.00 1.28e-03 . . . . 1587 1 255 no PDB 5CO6 . "Crystal Structure Of Human Zinc Insulin At Ph 6.5" . . . . . 95.24 21 100.00 100.00 1.28e-03 . . . . 1587 1 256 no PDB 5CO9 . "Crystal Structure Of Human Zinc Insulin At Ph 6.5" . . . . . 95.24 21 100.00 100.00 1.28e-03 . . . . 1587 1 257 no PDB 6INS . "X-Ray Analysis Of The Single Chain B29-A1 Peptide-Linked Insulin Molecule. A Completely Inactive Analogue" . . . . . 95.24 50 100.00 100.00 8.57e-04 . . . . 1587 1 258 no PDB 7INS . "Structure Of Porcine Insulin Cocrystallized With Clupeine Z" . . . . . 95.24 21 100.00 100.00 1.28e-03 . . . . 1587 1 259 no PDB 9INS . "Monovalent Cation Binding In Cubic Insulin Crystals" . . . . . 95.24 21 100.00 100.00 1.28e-03 . . . . 1587 1 260 no DBJ BAH59081 . "human M-proinsulin [synthetic construct]" . . . . . 95.24 87 100.00 100.00 3.08e-04 . . . . 1587 1 261 no DBJ BAJ17943 . "insulin [synthetic construct]" . . . . . 95.24 110 100.00 100.00 2.35e-04 . . . . 1587 1 262 no DBJ BAM29044 . "insulin, partial [Suncus murinus]" . . . . . 95.24 77 100.00 100.00 2.44e-04 . . . . 1587 1 263 no EMBL CAA23424 . "unnamed protein product [synthetic construct]" . . . . . 95.24 87 100.00 100.00 3.08e-04 . . . . 1587 1 264 no EMBL CAA23475 . "preproinsulin [Canis sp.]" . . . . . 95.24 110 100.00 100.00 2.57e-04 . . . . 1587 1 265 no EMBL CAA23828 . "preproinsulin [Homo sapiens]" . . . . . 95.24 110 100.00 100.00 2.35e-04 . . . . 1587 1 266 no EMBL CAA43403 . "Preproinsulin [Pan troglodytes]" . . . . . 95.24 110 100.00 100.00 2.98e-04 . . . . 1587 1 267 no EMBL CAA43405 . "Preproinsulin [Chlorocebus aethiops]" . . . . . 95.24 110 100.00 100.00 1.68e-04 . . . . 1587 1 268 no GB AAA17540 . "insulin, partial [Oryctolagus cuniculus]" . . . . . 95.24 55 100.00 100.00 2.31e-04 . . . . 1587 1 269 no GB AAA19033 . "insulin [Oryctolagus cuniculus]" . . . . . 95.24 110 100.00 100.00 2.42e-04 . . . . 1587 1 270 no GB AAA36849 . "preproinsulin [Macaca fascicularis]" . . . . . 95.24 110 100.00 100.00 1.54e-04 . . . . 1587 1 271 no GB AAA59172 . "insulin [Homo sapiens]" . . . . . 95.24 110 100.00 100.00 2.35e-04 . . . . 1587 1 272 no GB AAA59173 . "insulin [Homo sapiens]" . . . . . 95.24 110 100.00 100.00 2.35e-04 . . . . 1587 1 273 no PRF 0601246A . insulin,prepro . . . . . 95.24 110 100.00 100.00 2.35e-04 . . . . 1587 1 274 no PRF 1006230A . insulin,pro- . . . . . 95.24 86 100.00 100.00 3.12e-04 . . . . 1587 1 275 no PRF 550086A . insulin . . . . . 95.24 51 100.00 100.00 7.49e-04 . . . . 1587 1 276 no PRF 560164B . insulin . . . . . 95.24 21 100.00 100.00 1.28e-03 . . . . 1587 1 277 no PRF 580107B . insulin . . . . . 95.24 50 100.00 100.00 7.73e-04 . . . . 1587 1 278 no REF NP_000198 . "insulin preproprotein [Homo sapiens]" . . . . . 95.24 110 100.00 100.00 2.35e-04 . . . . 1587 1 279 no REF NP_001008996 . "insulin preproprotein [Pan troglodytes]" . . . . . 95.24 110 100.00 100.00 2.98e-04 . . . . 1587 1 280 no REF NP_001075804 . "insulin precursor [Oryctolagus cuniculus]" . . . . . 95.24 110 100.00 100.00 2.42e-04 . . . . 1587 1 281 no REF NP_001103242 . "insulin precursor [Sus scrofa]" . . . . . 95.24 108 100.00 100.00 2.34e-04 . . . . 1587 1 282 no REF NP_001123565 . "insulin precursor [Canis lupus familiaris]" . . . . . 95.24 110 100.00 100.00 2.57e-04 . . . . 1587 1 283 no SP P01308 . "RecName: Full=Insulin; Contains: RecName: Full=Insulin B chain; Contains: RecName: Full=Insulin A chain; Flags: Precursor" . . . . . 95.24 110 100.00 100.00 2.35e-04 . . . . 1587 1 284 no SP P01311 . "RecName: Full=Insulin; Contains: RecName: Full=Insulin B chain; Contains: RecName: Full=Insulin A chain; Flags: Precursor" . . . . . 95.24 110 100.00 100.00 2.42e-04 . . . . 1587 1 285 no SP P01315 . "RecName: Full=Insulin; Contains: RecName: Full=Insulin B chain; Contains: RecName: Full=Insulin A chain; Flags: Precursor" . . . . . 95.24 108 100.00 100.00 2.34e-04 . . . . 1587 1 286 no SP P01321 . "RecName: Full=Insulin; Contains: RecName: Full=Insulin B chain; Contains: RecName: Full=Insulin A chain; Flags: Precursor" . . . . . 95.24 110 100.00 100.00 2.57e-04 . . . . 1587 1 287 no SP P30406 . "RecName: Full=Insulin; Contains: RecName: Full=Insulin B chain; Contains: RecName: Full=Insulin A chain; Flags: Precursor" . . . . . 95.24 110 100.00 100.00 1.54e-04 . . . . 1587 1 stop_ loop_ _Entity_common_name.Name _Entity_common_name.Type _Entity_common_name.Entry_ID _Entity_common_name.Entity_ID 'insulin A chain' common 1587 1 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 . X . 1587 1 2 . ILE . 1587 1 3 . VAL . 1587 1 4 . GLU . 1587 1 5 . GLN . 1587 1 6 . CYS . 1587 1 7 . CYS . 1587 1 8 . THR . 1587 1 9 . SER . 1587 1 10 . ILE . 1587 1 11 . CYS . 1587 1 12 . SER . 1587 1 13 . LEU . 1587 1 14 . TYR . 1587 1 15 . GLN . 1587 1 16 . LEU . 1587 1 17 . GLU . 1587 1 18 . ASN . 1587 1 19 . TYR . 1587 1 20 . CYS . 1587 1 21 . ASN . 1587 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 . X 1 1 1587 1 . ILE 2 2 1587 1 . VAL 3 3 1587 1 . GLU 4 4 1587 1 . GLN 5 5 1587 1 . CYS 6 6 1587 1 . CYS 7 7 1587 1 . THR 8 8 1587 1 . SER 9 9 1587 1 . ILE 10 10 1587 1 . CYS 11 11 1587 1 . SER 12 12 1587 1 . LEU 13 13 1587 1 . TYR 14 14 1587 1 . GLN 15 15 1587 1 . LEU 16 16 1587 1 . GLU 17 17 1587 1 . ASN 18 18 1587 1 . TYR 19 19 1587 1 . CYS 20 20 1587 1 . ASN 21 21 1587 1 stop_ save_ #################### # Natural source # #################### save_natural_source _Entity_natural_src_list.Sf_category natural_source _Entity_natural_src_list.Sf_framecode natural_source _Entity_natural_src_list.Entry_ID 1587 _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.Subvariant _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.Cellular_location _Entity_natural_src.Fragment _Entity_natural_src.Fraction _Entity_natural_src.Secretion _Entity_natural_src.Plasmid _Entity_natural_src.Plasmid_details _Entity_natural_src.Gene_mnemonic _Entity_natural_src.Dev_stage _Entity_natural_src.Details _Entity_natural_src.Citation_ID _Entity_natural_src.Citation_label _Entity_natural_src.Entry_ID _Entity_natural_src.Entity_natural_src_list_ID 1 1 $insulin_A_chain . 9606 organism . 'Homo sapiens' Human . . Eukaryota Metazoa Homo sapiens . . . . . . . . . . . . . . . . . . . . . 1587 1 stop_ save_ ######################### # Experimental source # ######################### save_experimental_source _Entity_experimental_src_list.Sf_category experimental_source _Entity_experimental_src_list.Sf_framecode experimental_source _Entity_experimental_src_list.Entry_ID 1587 _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_subvariant _Entity_experimental_src.Host_org_organ _Entity_experimental_src.Host_org_tissue _Entity_experimental_src.Host_org_tissue_fraction _Entity_experimental_src.Host_org_cell_line _Entity_experimental_src.Host_org_cell_type _Entity_experimental_src.Host_org_cellular_location _Entity_experimental_src.Host_org_organelle _Entity_experimental_src.Host_org_gene _Entity_experimental_src.Host_org_culture_collection _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.Host_org_dev_stage _Entity_experimental_src.Details _Entity_experimental_src.Citation_ID _Entity_experimental_src.Citation_label _Entity_experimental_src.Entry_ID _Entity_experimental_src.Entity_experimental_src_list_ID 1 1 $insulin_A_chain . 'not available' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1587 1 stop_ save_ ##################################### # Sample contents and methodology # ##################################### ######################## # Sample description # ######################## save_sample_one _Sample.Sf_category sample _Sample.Sf_framecode sample_one _Sample.Entry_ID 1587 _Sample.ID 1 _Sample.Type solution _Sample.Sub_type . _Sample.Details . _Sample.Aggregate_sample_number . _Sample.Solvent_system . _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 . save_ ####################### # Sample conditions # ####################### save_sample_condition_set_one _Sample_condition_list.Sf_category sample_conditions _Sample_condition_list.Sf_framecode sample_condition_set_one _Sample_condition_list.Entry_ID 1587 _Sample_condition_list.ID 1 _Sample_condition_list.Details . 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 1.85 . na 1587 1 temperature 305 . K 1587 1 stop_ save_ ######################### # Experimental detail # ######################### ################################## # NMR Spectrometer definitions # ################################## save_spectrometer_list _NMR_spectrometer.Sf_category NMR_spectrometer _NMR_spectrometer.Sf_framecode spectrometer_list _NMR_spectrometer.Entry_ID 1587 _NMR_spectrometer.ID 1 _NMR_spectrometer.Details 'spectrometer information not available' _NMR_spectrometer.Manufacturer unknown _NMR_spectrometer.Model unknown _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 0 save_ save_NMR_spectrometer_list _NMR_spectrometer_list.Sf_category NMR_spectrometer_list _NMR_spectrometer_list.Sf_framecode NMR_spectrometer_list _NMR_spectrometer_list.Entry_ID 1587 _NMR_spectrometer_list.ID 1 loop_ _NMR_spectrometer_view.ID _NMR_spectrometer_view.Name _NMR_spectrometer_view.Manufacturer _NMR_spectrometer_view.Model _NMR_spectrometer_view.Serial_number _NMR_spectrometer_view.Field_strength _NMR_spectrometer_view.Details _NMR_spectrometer_view.Citation_ID _NMR_spectrometer_view.Citation_label _NMR_spectrometer_view.Entry_ID _NMR_spectrometer_view.NMR_spectrometer_list_ID 1 spectrometer_1 unknown unknown . 0 'spectrometer information not available' . . 1587 1 stop_ save_ ############################# # NMR applied experiments # ############################# save_experiment_list _Experiment_list.Sf_category experiment_list _Experiment_list.Sf_framecode experiment_list _Experiment_list.Entry_ID 1587 _Experiment_list.ID 1 _Experiment_list.Details . loop_ _Experiment.ID _Experiment.Name _Experiment.Raw_data_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.Entry_ID _Experiment.Experiment_list_ID 1 . . . . . . . . . . . . 1 $sample_one . . . 1 $sample_condition_set_one . . . 1 $spectrometer_list . . . . . . . . . . . . . . . . 1587 1 stop_ save_ #################### # NMR parameters # #################### ############################## # Assigned chemical shifts # ############################## ################################ # Chemical shift referencing # ################################ save_chem_shift_reference_par_set_one _Chem_shift_reference.Sf_category chem_shift_reference _Chem_shift_reference.Sf_framecode chem_shift_reference_par_set_one _Chem_shift_reference.Entry_ID 1587 _Chem_shift_reference.ID 1 _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.Indirect_shift_ratio_cit_ID _Chem_shift_ref.Indirect_shift_ratio_cit_label _Chem_shift_ref.Ref_correction_type _Chem_shift_ref.Correction_val _Chem_shift_ref.Correction_val_cit_ID _Chem_shift_ref.Correction_val_cit_label _Chem_shift_ref.Entry_ID _Chem_shift_ref.Chem_shift_reference_ID H . DSS . . . . . ppm 0 . . . . . . 1 $entry_citation . . 1 $entry_citation 1587 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_chemical_shift_assignment_data_set_one _Assigned_chem_shift_list.Sf_category assigned_chemical_shifts _Assigned_chem_shift_list.Sf_framecode 'chemical_shift_assignment_data_set_one' _Assigned_chem_shift_list.Entry_ID 1587 _Assigned_chem_shift_list.ID 1 _Assigned_chem_shift_list.Sample_condition_list_ID 1 _Assigned_chem_shift_list.Sample_condition_list_label $sample_condition_set_one _Assigned_chem_shift_list.Chem_shift_reference_ID 1 _Assigned_chem_shift_list.Chem_shift_reference_label $chem_shift_reference_par_set_one _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 $sample_one . 1587 1 stop_ loop_ _Atom_chem_shift.ID _Atom_chem_shift.Assembly_atom_ID _Atom_chem_shift.Entity_assembly_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.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 11 11 CYS HB2 H 1 3.35 0.02 . 2 . . . . . . . . 1587 1 2 . 1 1 11 11 CYS HB3 H 1 3.18 0.02 . 2 . . . . . . . . 1587 1 stop_ save_