data_994 ####################### # Entry information # ####################### save_entry_information _Saveframe_category entry_information _Entry_title ; Sequence-specific 1H-NMR assignments for the aromatic region of several biologically active, monomeric insulins including native human insulin ; _BMRB_accession_number 994 _BMRB_flat_file_name bmr994.str _Entry_type update _Submission_date 1995-07-31 _Accession_date 1996-04-13 _Entry_origination BMRB _NMR_STAR_version 2.1.1 _Experimental_method NMR _Details . loop_ _Author_ordinal _Author_family_name _Author_given_name _Author_middle_initials _Author_family_title 1 Roy Melinda . . 2 Lee Robert W.-K. . 3 Kaarsholm Niels C. . 4 Thogersen Henning . . 5 Brange Jens . . 6 Dunn M. F. . stop_ loop_ _Saveframe_category_type _Saveframe_category_type_count assigned_chemical_shifts 1 stop_ loop_ _Data_type _Data_type_count "1H chemical shifts" 8 stop_ loop_ _Revision_date _Revision_keyword _Revision_author _Revision_detail 2010-06-11 revision BMRB 'Complete natural source information' 1999-06-14 revision BMRB 'Converted to BMRB NMR-STAR V 2.1 format' 1996-04-13 revision BMRB 'Link to the Protein Data Bank added' 1996-03-25 reformat BMRB 'Converted to the BMRB 1996-03-01 STAR flat-file format' 1995-07-31 original BMRB 'Last release in original BMRB flat-file format' stop_ save_ ############################# # Citation for this entry # ############################# save_entry_citation _Saveframe_category entry_citation _Citation_full ; Roy, Melinda, Lee, Robert W.-K., Kaarsholm, Niels C., Thogersen, Henning, Brange, Jens, Dunn, M.F., "Sequence-specific 1H-NMR assignments for the aromatic region of several biologically active, monomeric insulins including native human insulin," Biochim. Biophys. Acta 1053, 63-73 (1990). ; _Citation_title ; Sequence-specific 1H-NMR assignments for the aromatic region of several biologically active, monomeric insulins including native human insulin ; _Citation_status published _Citation_type journal _CAS_abstract_code . _MEDLINE_UI_code . _PubMed_ID ? loop_ _Author_ordinal _Author_family_name _Author_given_name _Author_middle_initials _Author_family_title 1 Roy Melinda . . 2 Lee Robert W.-K. . 3 Kaarsholm Niels C. . 4 Thogersen Henning . . 5 Brange Jens . . 6 Dunn M. F. . stop_ _Journal_abbreviation 'Biochim. Biophys. Acta' _Journal_volume 1053 _Journal_issue . _Journal_CSD . _Book_chapter_title . _Book_volume . _Book_series . _Book_ISBN . _Conference_state_province . _Conference_abstract_number . _Page_first 63 _Page_last 73 _Year 1990 _Details . save_ ################################## # Molecular system description # ################################## save_system_insulin_A_chain _Saveframe_category molecular_system _Mol_system_name 'insulin A chain' _Enzyme_commission_number . loop_ _Mol_system_component_name _Mol_label 'insulin A chain' $insulin_A_chain stop_ _System_molecular_weight . _System_oligomer_state ? _System_paramagnetic ? _System_thiol_state . _Database_query_date . _Details . save_ ######################## # Monomeric polymers # ######################## save_insulin_A_chain _Saveframe_category monomeric_polymer _Mol_type polymer _Mol_polymer_class protein _Name_common 'insulin A chain' _Molecular_mass . _Mol_thiol_state . _Details . ############################## # Polymer residue sequence # ############################## _Residue_count 21 _Mol_residue_sequence ; GIVEQCCTSICSLYQLENYC N ; loop_ _Residue_seq_code _Residue_label 1 GLY 2 ILE 3 VAL 4 GLU 5 GLN 6 CYS 7 CYS 8 THR 9 SER 10 ILE 11 CYS 12 SER 13 LEU 14 TYR 15 GLN 16 LEU 17 GLU 18 ASN 19 TYR 20 CYS 21 ASN stop_ _Sequence_homology_query_date . _Sequence_homology_query_revised_last_date 2015-01-28 loop_ _Database_name _Database_accession_code _Database_entry_mol_name _Sequence_query_to_submitted_percentage _Sequence_subject_length _Sequence_identity _Sequence_positive _Sequence_homology_expectation_value BMRB 1000 "insulin A chain" 100.00 21 100.00 100.00 1.03e-04 BMRB 1002 "insulin A chain" 100.00 21 100.00 100.00 1.03e-04 BMRB 1004 "insulin A chain" 100.00 21 100.00 100.00 1.03e-04 BMRB 1006 "insulin A chain" 100.00 21 100.00 100.00 1.03e-04 BMRB 1008 "insulin A chain" 100.00 21 100.00 100.00 1.03e-04 BMRB 1010 "insulin A chain" 100.00 21 100.00 100.00 1.03e-04 BMRB 1012 "insulin A chain" 100.00 21 100.00 100.00 1.03e-04 BMRB 1014 "insulin A chain" 100.00 21 100.00 100.00 1.03e-04 BMRB 1016 "insulin A chain" 100.00 21 100.00 100.00 1.03e-04 BMRB 1018 "insulin A chain" 100.00 21 100.00 100.00 1.03e-04 BMRB 1020 "insulin A chain" 100.00 21 100.00 100.00 1.03e-04 BMRB 1022 "insulin A chain" 100.00 21 100.00 100.00 1.03e-04 BMRB 1023 "insulin B chain" 95.24 42 100.00 100.00 7.14e-04 BMRB 11016 "Chain A" 100.00 21 100.00 100.00 1.03e-04 BMRB 1344 "insulin A chain" 100.00 21 100.00 100.00 1.03e-04 BMRB 15464 "chain A" 100.00 21 100.00 100.00 1.03e-04 BMRB 1585 "insulin A chain" 95.24 21 100.00 100.00 8.72e-04 BMRB 1587 "insulin A chain" 95.24 21 100.00 100.00 8.72e-04 BMRB 16026 INSULIN_A_CHAIN 100.00 21 100.00 100.00 1.03e-04 BMRB 16027 INSULIN_A_CHAIN 100.00 21 100.00 100.00 1.03e-04 BMRB 1632 "insulin A chain" 100.00 21 100.00 100.00 1.03e-04 BMRB 16343 INSULIN_A_CHAIN 100.00 21 100.00 100.00 1.03e-04 BMRB 16608 Proinsulin 100.00 86 100.00 100.00 4.07e-05 BMRB 16663 "entity, chain 1" 100.00 21 100.00 100.00 1.03e-04 BMRB 16915 "entity, chain 1" 100.00 22 100.00 100.00 1.10e-04 BMRB 17107 entity_1 100.00 21 100.00 100.00 1.03e-04 BMRB 1761 "insulin A chain" 100.00 21 100.00 100.00 1.03e-04 BMRB 17803 "InsulinGR 1" 100.00 22 100.00 100.00 1.10e-04 BMRB 18858 entity_1 100.00 21 100.00 100.00 1.03e-04 BMRB 18859 entity_1 100.00 21 100.00 100.00 1.03e-04 BMRB 18921 chain_A 100.00 21 100.00 100.00 1.03e-04 BMRB 18923 chain_A 100.00 21 100.00 100.00 1.03e-04 BMRB 18924 chain_A 100.00 21 100.00 100.00 1.03e-04 BMRB 18925 chain_A 100.00 21 100.00 100.00 1.03e-04 BMRB 19822 entity_1 100.00 21 100.00 100.00 1.03e-04 BMRB 19978 entity_1 100.00 21 100.00 100.00 1.03e-04 BMRB 19979 entity 100.00 51 100.00 100.00 8.23e-05 BMRB 20052 Human_Insulin_A-chain_peptide 71.43 15 100.00 100.00 3.11e+00 BMRB 20053 Insulin_A-chain_variant_peptide 71.43 17 100.00 100.00 2.24e+00 BMRB 25260 entity_1 100.00 21 100.00 100.00 1.03e-04 BMRB 25261 entity_1 100.00 21 100.00 100.00 1.03e-04 BMRB 4266 D-AlaB26_DTI-amide 100.00 47 100.00 100.00 7.31e-05 BMRB 554 "insulin A chain" 100.00 21 100.00 100.00 1.03e-04 BMRB 556 "insulin A chain" 100.00 21 100.00 100.00 1.03e-04 BMRB 936 "insulin A chain" 100.00 21 100.00 100.00 1.03e-04 BMRB 996 "insulin A chain" 100.00 21 100.00 100.00 1.03e-04 BMRB 998 "insulin A chain" 100.00 21 100.00 100.00 1.03e-04 PDB 1A7F "Insulin Mutant B16 Glu, B24 Gly, Des-B30, Nmr, 20 Structures" 100.00 21 100.00 100.00 1.03e-04 PDB 1AI0 "R6 Human Insulin Hexamer (Non-Symmetric), Nmr, 10 Structures" 100.00 21 100.00 100.00 1.03e-04 PDB 1AIY "R6 Human Insulin Hexamer (Symmetric), Nmr, 10 Structures" 100.00 21 100.00 100.00 1.03e-04 PDB 1B17 "Ph Affects Glu B13 Switching And Sulfate Binding In Cubic Insulin Crystals (Ph 5.00 Coordinates)" 100.00 21 100.00 100.00 1.03e-04 PDB 1B18 "Ph Affects Glu B13 Switching And Sulfate Binding In Cubic Insulin Crystals (Ph 5.53 Coordinates)" 100.00 21 100.00 100.00 1.03e-04 PDB 1B19 "Ph Affects Glu B13 Switching And Sulfate Binding In Cubic Insulin Crystals (Ph 5.80 Coordinates)" 100.00 21 100.00 100.00 1.03e-04 PDB 1B2A "Ph Affects Glu B13 Switching And Sulfate Binding In Cubic Insulin Crystals (Ph 6.00 Coordinates)" 100.00 21 100.00 100.00 1.03e-04 PDB 1B2B "Ph Affects Glu B13 Switching And Sulfate Binding In Cubic Insulin Crystals (Ph 6.16 Coordinates)" 100.00 21 100.00 100.00 1.03e-04 PDB 1B2C "Ph Affects Glu B13 Switching And Sulfate Binding In Cubic Insulin Crystals (Ph 6.26 Coordinates)" 100.00 21 100.00 100.00 1.03e-04 PDB 1B2D "Ph Affects Glu B13 Switching And Sulfate Binding In Cubic Insulin Crystals (Ph 6.35 Coordinates)" 100.00 21 100.00 100.00 1.03e-04 PDB 1B2E "Ph Affects Glu B13 Switching And Sulfate Binding In Cubic Insulin Crystals (Ph 6.50 Coordinates)" 100.00 21 100.00 100.00 1.03e-04 PDB 1B2F "Ph Affects Glu B13 Switching And Sulfate Binding In Cubic Insulin Crystals (Ph 6.98 Coordinates)" 100.00 21 100.00 100.00 1.03e-04 PDB 1B2G "Ph Affects Glu B13 Switching And Sulfate Binding In Cubic Insulin Crystals (Ph 9.00 Coordinates)" 100.00 21 100.00 100.00 1.03e-04 PDB 1B9E "Human Insulin Mutant Serb9glu" 100.00 21 100.00 100.00 1.03e-04 PDB 1BEN "Insulin Complexed With 4-Hydroxybenzamide" 95.24 21 100.00 100.00 8.72e-04 PDB 1BZV "[d-Alab26]-Des(B27-B30)-Insulin-B26-Amide A Superpotent Single-Replacement Insulin Analogue, Nmr, Minimized Average Structure" 100.00 21 100.00 100.00 1.03e-04 PDB 1DEI "Desheptapeptide (B24-B30) Insulin" 100.00 21 100.00 100.00 1.03e-04 PDB 1EFE "An Active Mini-Proinsulin, M2pi" 100.00 60 100.00 100.00 5.91e-05 PDB 1EV3 "Structure Of The Rhombohedral Form Of The M-cresol/insulin R6 Hexamer" 100.00 21 100.00 100.00 1.03e-04 PDB 1EV6 "Structure Of The Monoclinic Form Of The M-CresolINSULIN R6 Hexamer" 100.00 21 100.00 100.00 1.03e-04 PDB 1EVR "The Structure Of The ResorcinolINSULIN R6 HEXAMER" 100.00 21 100.00 100.00 1.03e-04 PDB 1FU2 "First Protein Structure Determined From X-Ray Powder Diffraction Data" 100.00 21 100.00 100.00 1.03e-04 PDB 1FUB "First Protein Structure Determined From X-Ray Powder Diffraction Data" 100.00 21 100.00 100.00 1.03e-04 PDB 1G7A "1.2 A Structure Of T3r3 Human Insulin At 100 K" 100.00 21 100.00 100.00 1.03e-04 PDB 1G7B "1.3 A Structure Of T3r3 Human Insulin At 100 K" 100.00 21 100.00 100.00 1.03e-04 PDB 1GUJ "Insulin At Ph 2: Structural Analysis Of The Conditions Promoting Insulin Fibre Formation." 100.00 21 100.00 100.00 1.03e-04 PDB 1HIQ "Paradoxical Structure And Function In A Mutant Human Insulin Associated With Diabetes Mellitus" 100.00 21 100.00 100.00 1.03e-04 PDB 1HIS "Structure And Dynamics Of Des-Pentapeptide-Insulin In Solution: The Molten-Globule Hypothesis." 100.00 21 100.00 100.00 1.03e-04 PDB 1HIT "Receptor Binding Redefined By A Structural Switch In A Mutant Human Insulin" 100.00 21 100.00 100.00 1.03e-04 PDB 1HLS "Nmr Structure Of The Human Insulin-His(B16)" 100.00 21 100.00 100.00 1.03e-04 PDB 1HTV "Crystal Structure Of Destripeptide (B28-B30) Insulin" 100.00 21 100.00 100.00 1.03e-04 PDB 1HUI "Insulin Mutant (B1, B10, B16, B27)glu, Des-B30, Nmr, 25 Structures" 100.00 21 100.00 100.00 1.03e-04 PDB 1IZA "Role Of B13 Glu In Insulin Assembly: The Hexamer Structure Of Recombinant Mutant (B13 Glu-> Gln) Insulin" 100.00 21 100.00 100.00 1.03e-04 PDB 1IZB "Role Of B13 Glu In Insulin Assembly: The Hexamer Structure Of Recombinant Mutant (B13 Glu-> Gln) Insulin" 100.00 21 100.00 100.00 1.03e-04 PDB 1JCO "Solution Structure Of The Monomeric [thr(B27)->pro,Pro(B28)- >thr] Insulin Mutant (Pt Insulin)" 100.00 21 100.00 100.00 1.03e-04 PDB 1LPH "Lys(B28)pro(B29)-Human Insulin" 100.00 21 100.00 100.00 1.03e-04 PDB 1M5A "Crystal Structure Of 2-Co(2+)-Insulin At 1.2a Resolution" 100.00 21 100.00 100.00 1.03e-04 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 8.72e-04 PDB 1MHJ "Solution Structure Of The Superactive Monomeric Des- [phe(B25)] Human Insulin Mutant. Elucidation Of The Structural Basis For T" 100.00 21 100.00 100.00 1.03e-04 PDB 1MPJ "X-Ray Crystallographic Studies On Hexameric Insulins In The Presence Of Helix-Stabilizing Agents, Thiocyanate, Methylparaben An" 100.00 21 100.00 100.00 1.03e-04 PDB 1MSO "T6 Human Insulin At 1.0 A Resolution" 100.00 21 100.00 100.00 1.03e-04 PDB 1OS3 "Dehydrated T6 Human Insulin At 100 K" 100.00 21 100.00 100.00 1.03e-04 PDB 1OS4 "Dehydrated T6 Human Insulin At 295 K" 100.00 21 100.00 100.00 1.03e-04 PDB 1QIY "Human Insulin Hexamers With Chain B His Mutated To Tyr Complexed With Phenol" 100.00 21 100.00 100.00 1.03e-04 PDB 1QIZ "Human Insulin Hexamers With Chain B His Mutated To Tyr Complexed With Resorcinol" 100.00 21 100.00 100.00 1.03e-04 PDB 1QJ0 "Human Insulin Hexamers With Chain B His Mutated To Tyr" 100.00 21 100.00 100.00 1.03e-04 PDB 1SDB "Porcine Desb1-2 Despentapeptide(B26-B30) Insulin" 100.00 21 100.00 100.00 1.03e-04 PDB 1SF1 "Nmr Structure Of Human Insulin Under Amyloidogenic Condition, 15 Structures" 100.00 21 100.00 100.00 1.03e-04 PDB 1SJT "Mini-Proinsulin, Two Chain Insulin Analog Mutant: Des B30, His(B 10)asp, Pro(B 28)asp, Nmr, 20 Structures" 100.00 21 100.00 100.00 1.03e-04 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 " 100.00 50 100.00 100.00 7.80e-05 PDB 1T1K "Nmr Structure Of Human Insulin Mutant His-B10-Asp, Val-B12- Ala, Pro-B28-Lys, Lys-B29-Pro, 15 Structures" 100.00 21 100.00 100.00 1.03e-04 PDB 1T1P "Nmr Structure Of Human Insulin Mutant His-B10-Asp, Val-B12- Thr, Pro-B28-Lys, Lys-B29-Pro, 15 Structures" 100.00 21 100.00 100.00 1.03e-04 PDB 1T1Q "Nmr Structure Of Human Insulin Mutant His-B10-Asp, Val-B12-Aba, Pro- B28-Lys, Lys-B29-Pro, 15 Structures" 100.00 21 100.00 100.00 1.03e-04 PDB 1TRZ "Crystallographic Evidence For Dual Coordination Around Zinc In The T3r3 Human Insulin Hexamer" 100.00 21 100.00 100.00 1.03e-04 PDB 1TYL "The Structure Of A Complex Of Hexameric Insulin And 4'- Hydroxyacetanilide" 100.00 21 100.00 100.00 1.03e-04 PDB 1TYM "The Structure Of A Complex Of Hexameric Insulin And 4'- Hydroxyacetanilide" 100.00 21 100.00 100.00 1.03e-04 PDB 1UZ9 "Crystallographic And Solution Studies Of N-Lithocholyl Insulin: A New Generation Of Prolonged-Acting Insulins." 100.00 21 100.00 100.00 1.03e-04 PDB 1W8P "Structural Properties Of The B25tyr-Nme-B26phe Insulin Mutant." 100.00 21 100.00 100.00 1.03e-04 PDB 1WAV "Crystal Structure Of Form B Monoclinic Crystal Of Insulin" 100.00 21 100.00 100.00 1.03e-04 PDB 1XDA "Structure Of Insulin" 100.00 21 100.00 100.00 1.03e-04 PDB 1XGL "Human Insulin Disulfide Isomer, Nmr, 10 Structures" 100.00 21 100.00 100.00 1.03e-04 PDB 1ZEG "Structure Of B28 Asp Insulin In Complex With Phenol" 100.00 21 100.00 100.00 1.03e-04 PDB 1ZEH "Structure Of Insulin" 100.00 21 100.00 100.00 1.03e-04 PDB 1ZEI "Cross-Linked B28 Asp Insulin" 100.00 53 100.00 100.00 5.73e-05 PDB 1ZNI Insulin 100.00 21 100.00 100.00 1.03e-04 PDB 1ZNJ "Insulin, Monoclinic Crystal Form" 100.00 21 100.00 100.00 1.03e-04 PDB 2AIY "R6 Human Insulin Hexamer (Symmetric), Nmr, 20 Structures" 100.00 21 100.00 100.00 1.03e-04 PDB 2C8Q "Insuline(1sec) And Uv Laser Excited Fluorescence" 100.00 21 100.00 100.00 1.03e-04 PDB 2C8R "Insuline(60sec) And Uv Laser Excited Fluorescence" 100.00 21 100.00 100.00 1.03e-04 PDB 2CEU "Despentapeptide Insulin In Acetic Acid (Ph 2)" 100.00 21 100.00 100.00 1.03e-04 PDB 2EFA "Neutron Crystal Structure Of Cubic Insulin At Pd6.6" 100.00 21 100.00 100.00 1.03e-04 PDB 2G4M "Insulin Collected At 2.0 A Wavelength" 100.00 21 100.00 100.00 1.03e-04 PDB 2H67 "Nmr Structure Of Human Insulin Mutant His-B5-Ala, His-B10- Asp Pro-B28-Lys, Lys-B29-Pro, 20 Structures" 100.00 21 100.00 100.00 1.03e-04 PDB 2HH4 "Nmr Structure Of Human Insulin Mutant Gly-B8-D-Ser, His-B10- Asp Pro-B28-Lys, Lys-B29-Pro, 20 Structures" 100.00 21 100.00 100.00 1.03e-04 PDB 2HHO "Nmr Structure Of Human Insulin Mutant Gly-B8-Ser, His-B10- Asp Pro-B28-Lys, Lys-B29-Pro, 20 Structures" 100.00 21 100.00 100.00 1.03e-04 PDB 2HIU "Nmr Structure Of Human Insulin In 20% Acetic Acid, Zinc- Free, 10 Structures" 100.00 21 100.00 100.00 1.03e-04 PDB 2JMN "Nmr Structure Of Human Insulin Mutant His-B10-Asp, Pro-B28- Lys, Lys-B29-Pro, 20 Structures" 100.00 21 100.00 100.00 1.03e-04 PDB 2JV1 "Nmr Structure Of Human Insulin Monomer In 35% Cd3cn Zinc Free, 50 Structures" 100.00 21 100.00 100.00 1.03e-04 PDB 2K91 "Enhancing The Activity Of Insulin By Stereospecific Unfolding" 100.00 21 100.00 100.00 1.03e-04 PDB 2K9R "Enhancing The Activity Of Insulin By Stereospecific Unfolding" 100.00 21 100.00 100.00 1.03e-04 PDB 2KJJ "Dynamics Of Insulin Probed By 1h-Nmr Amide Proton Exchange A Flexibility Of The Receptor-Binding Surface" 100.00 21 100.00 100.00 1.03e-04 PDB 2KJU "Nmr Structure Of Human Insulin Mutant Glu-B21-D-Glu, His-B10 B28-Lys, Lys-B29-Pro, 20 Structures" 100.00 21 100.00 100.00 1.03e-04 PDB 2KQP "Nmr Structure Of Proinsulin" 100.00 86 100.00 100.00 4.07e-05 PDB 2KQQ "Nmr Structure Of Human Insulin Mutant Gly-B8-D-Ala, His-B10-Asp, Pro- B28-Lys, Lys-B29-Pro, 20 Structures" 100.00 21 100.00 100.00 1.03e-04 PDB 2KXK "Human Insulin Mutant A22gly-B31lys-B32arg" 100.00 22 100.00 100.00 1.10e-04 PDB 2L1Y "Nmr Structure Of Human Insulin Mutant Gly-B20-D-Ala, Gly-B23-D-Ala Pro-B28-Lys, Lys-B29-Pro, 20 Structures" 100.00 21 100.00 100.00 1.03e-04 PDB 2LGB "Modified A22gly-B31arg Human Insulin" 100.00 22 100.00 100.00 1.10e-04 PDB 2M1D "Biosynthetic Engineered B28k-b29p Human Insulin Monomer Structure In In Water/acetonitrile Solutions." 100.00 21 100.00 100.00 1.03e-04 PDB 2M1E "Biosynthetic Engineered B28k-b29p Human Insulin Monomer Structure In In Water Solutions." 100.00 21 100.00 100.00 1.03e-04 PDB 2M2M "Structure Of [l-hisb24] Insulin Analogue At Ph 1.9" 100.00 21 100.00 100.00 1.03e-04 PDB 2M2N "Structure Of [l-hisb24] Insulin Analogue At Ph 8.0" 100.00 21 100.00 100.00 1.03e-04 PDB 2M2O "Structure Of [d-hisb24] Insulin Analogue At Ph 1.9" 100.00 21 100.00 100.00 1.03e-04 PDB 2M2P "Structure Of [d-hisb24] Insulin Analogue At Ph 8.0" 100.00 21 100.00 100.00 1.03e-04 PDB 2MLI "Nmr Structure Of B25-(alpha, Beta)-dehydro-phenylalanine Insulin" 100.00 21 100.00 100.00 1.03e-04 PDB 2MPG "Solution Structure Of The [aibb8,lysb28,prob29]-insulin Analogue" 100.00 21 100.00 100.00 1.03e-04 PDB 2MVC "Solution Structure Of Human Insulin At Ph 1.9" 100.00 21 100.00 100.00 1.03e-04 PDB 2MVD "Solution Structure Of [glnb22]-insulin Mutant At Ph 1.9" 100.00 21 100.00 100.00 1.03e-04 PDB 2OLY "Structure Of Human Insulin In Presence Of Urea At Ph 7.0" 100.00 21 100.00 100.00 1.03e-04 PDB 2OLZ "Structure Of Human Insulin In Presence Of Thiocyanate At Ph 7.0" 100.00 21 100.00 100.00 1.03e-04 PDB 2OM0 "Structure Of Human Insulin In Presence Of Urea At Ph 6.5" 100.00 21 100.00 100.00 1.03e-04 PDB 2OM1 "Structure Of Human Insulin In Presence Of Thiocyanate At Ph 6.5" 100.00 21 100.00 100.00 1.03e-04 PDB 2OMG "Structure Of Human Insulin Cocrystallized With Protamine And Urea" 100.00 21 100.00 100.00 1.03e-04 PDB 2OMH "Structure Of Human Insulin Cocrystallized With Arg-12 Peptide In Presence Of Urea" 100.00 21 100.00 100.00 1.03e-04 PDB 2OMI "Structure Of Human Insulin Cocrystallized With Protamine" 100.00 21 100.00 100.00 1.03e-04 PDB 2QIU "Structure Of Human Arg-Insulin" 100.00 22 100.00 100.00 9.06e-05 PDB 2R34 "Crystal Structure Of Mn Human Arg-Insulin" 100.00 22 100.00 100.00 9.06e-05 PDB 2R35 "Crystal Structure Of Rb Human Arg-Insulin" 100.00 22 100.00 100.00 9.06e-05 PDB 2R36 "Crystal Structure Of Ni Human Arg-Insulin" 100.00 22 100.00 100.00 9.06e-05 PDB 2RN5 "Humal Insulin Mutant B31lys-B32arg" 100.00 21 100.00 100.00 1.03e-04 PDB 2TCI "X-Ray Crystallographic Studies On Hexameric Insulins In The Presence Of Helix-Stabilizing Agents, Thiocyanate, Methylparaben An" 100.00 21 100.00 100.00 1.03e-04 PDB 2VJZ "Crystal Structure Form Ultalente Insulin Microcrystals" 100.00 21 100.00 100.00 1.03e-04 PDB 2VK0 "Crystal Structure Form Ultalente Insulin Microcrystals" 100.00 21 100.00 100.00 1.03e-04 PDB 2W44 "Structure Deltaa1-a4 Insulin" 80.95 17 100.00 100.00 8.44e-02 PDB 2WBY "Crystal Structure Of Human Insulin-Degrading Enzyme In Complex With Insulin" 95.24 20 100.00 100.00 6.41e-04 PDB 2WC0 "Crystal Structure Of Human Insulin Degrading Enzyme In Complex With Iodinated Insulin" 100.00 21 100.00 100.00 1.03e-04 PDB 2WRU "Semi-synthetic Highly Active Analogue Of Human Insulin Nmealab26-dti-nh2" 100.00 21 100.00 100.00 1.03e-04 PDB 2WRV "Semi-Synthetic Highly Active Analogue Of Human Insulin Nmehisb26-Dti-Nh2" 100.00 21 100.00 100.00 1.03e-04 PDB 2WRW "Semi-Synthetic Highly Active Analogue Of Human Insulin D- Prob26-Dti-Nh2" 100.00 21 100.00 100.00 1.03e-04 PDB 2WRX "Semi-Synthetic Analogue Of Human Insulin Nmealab26-Insulin At Ph 3.0" 100.00 21 100.00 100.00 1.03e-04 PDB 2WS0 "Semi-Synthetic Analogue Of Human Insulin Nmealab26-Insulin At Ph 7.5" 100.00 21 100.00 100.00 1.03e-04 PDB 2WS1 "Semi-Synthetic Analogue Of Human Insulin Nmetyrb26-Insulin In Monomer Form" 100.00 21 100.00 100.00 1.03e-04 PDB 2WS4 "Semi-Synthetic Analogue Of Human Insulin Prob26-Dti In Monomer Form" 100.00 21 100.00 100.00 1.03e-04 PDB 2WS6 "Semi-Synthetic Analogue Of Human Insulin Nmetyrb26-Insulin In Hexamer Form" 100.00 21 100.00 100.00 1.03e-04 PDB 2WS7 "Semi-Synthetic Analogue Of Human Insulin Prob26-Dti" 100.00 21 100.00 100.00 1.03e-04 PDB 2ZPP "Neutron Crystal Structure Of Cubic Insulin At Pd9" 100.00 21 100.00 100.00 1.03e-04 PDB 3AIY "R6 Human Insulin Hexamer (Symmetric), Nmr, Refined Average Structure" 100.00 21 100.00 100.00 1.03e-04 PDB 3BRR "Crystal Structure Of Insulin In Complex With Sulfatide" 100.00 21 100.00 100.00 1.03e-04 PDB 3BXQ "The Structure Of A Mutant Insulin Uncouples Receptor Binding From Protein Allostery. An Electrostatic Block To The Tr Transitio" 100.00 21 100.00 100.00 1.03e-04 PDB 3E7Y "Structure Of Human Insulin" 100.00 21 100.00 100.00 1.03e-04 PDB 3E7Z "Structure Of Human Insulin" 100.00 21 100.00 100.00 1.03e-04 PDB 3EXX "Structure Of The T6 Human Insulin Derivative With Nickel At 1.35 A Resolution" 100.00 21 100.00 100.00 1.03e-04 PDB 3FHP "A Neutron Crystallographic Analysis Of A Porcine 2zn Insulin At 2.0 A Resolution" 100.00 21 100.00 100.00 1.03e-04 PDB 3I3Z "Human Insulin" 100.00 21 100.00 100.00 1.03e-04 PDB 3I40 "Human Insulin" 100.00 21 100.00 100.00 1.03e-04 PDB 3ILG "Crystal Structure Of Humnan Insulin Sr+2 Complex" 100.00 21 100.00 100.00 1.03e-04 PDB 3INC "Crystal Structure Of Human Insulin With Ni+2 Complex" 100.00 21 100.00 100.00 1.03e-04 PDB 3INS "Structure Of Insulin. Results Of Joint Neutron And X-ray Refinement" 100.00 21 100.00 100.00 1.03e-04 PDB 3IR0 "Crystal Structure Of Human Insulin Complexed With Cu+2 Metal Ion" 100.00 21 100.00 100.00 1.03e-04 PDB 3JSD "Insulin's Biosynthesis And Activity Have Opposing Structural Requirements: A New Factor In Neonatal Diabetes Mellitus" 100.00 21 100.00 100.00 1.03e-04 PDB 3MTH "X-Ray Crystallographic Studies On Hexameric Insulins In The Presence Of Helix-Stabilizing Agents, Thiocyanate, Methylparaben An" 100.00 21 100.00 100.00 1.03e-04 PDB 3P2X "Insulin Fibrillation Is The Janus Face Of Induced Fit. A Chiaral Clamp Stabilizes The Native State At The Expense Of Activity" 100.00 21 100.00 100.00 1.03e-04 PDB 3P33 "Insulin Fibrillation Is The Janus Face Of Induced Fit. A Chiral Clamp Stabilizes The Native State At The Expense Of Activity" 100.00 21 100.00 100.00 1.03e-04 PDB 3Q6E "Human Insulin In Complex With Cucurbit[7]uril" 100.00 21 100.00 100.00 1.03e-04 PDB 3ROV "Insulin's Biosynthesis And Activity Have Opposing Structural Requirements: A New Factor In Neonatal Diabetes Mellitus" 100.00 21 100.00 100.00 1.03e-04 PDB 3RTO "Acoustically Mounted Porcine Insulin Microcrystals Yield An X-Ray Sad Structure" 100.00 21 100.00 100.00 1.03e-04 PDB 3T2A "Tmao-Grown Cubic Insulin (Porcine)" 100.00 21 100.00 100.00 1.03e-04 PDB 3TT8 "Crystal Structure Analysis Of Cu Human Insulin Derivative" 100.00 21 100.00 100.00 1.03e-04 PDB 3U4N "A Novel Covalently Linked Insulin Dimer" 100.00 21 100.00 100.00 1.03e-04 PDB 3V1G "Forestalling Insulin Fibrillation By Insertion Of A Chiral Clamp Mechanism-Based Application Of Protein Engineering To Global H" 100.00 21 100.00 100.00 1.03e-04 PDB 3W11 "Insulin Receptor Ectodomain Construct Comprising Domains L1-cr In Complex With Human Insulin, Alpha-ct Peptide(704-719) And Fab" 100.00 21 100.00 100.00 1.03e-04 PDB 3W12 "Insulin Receptor Ectodomain Construct Comprising Domains L1-cr In Complex With High-affinity Insulin Analogue [d-pro-b26]-dti-n" 100.00 21 100.00 100.00 1.03e-04 PDB 3W13 "Insulin Receptor Ectodomain Construct Comprising Domains L1-cr In Complex With High-affinity Insulin Analogue [d-pro-b26]-dti-n" 100.00 21 100.00 100.00 1.03e-04 PDB 3W7Y "0.92a Structure Of 2zn Human Insulin At 100k" 100.00 21 100.00 100.00 1.03e-04 PDB 3W7Z "1.15a Structure Of Human 2zn Insulin At 293k" 100.00 21 100.00 100.00 1.03e-04 PDB 3W80 "Crystal Structure Of Dodecamer Human Insulin With Double C-axis Length Of The Hexamer 2 Zn Insulin Cell" 100.00 21 100.00 100.00 1.03e-04 PDB 3ZI3 "Crystal Structure Of The B24his-insulin - Human Analogue" 100.00 21 100.00 100.00 1.03e-04 PDB 3ZQR "Nmepheb25 Insulin Analogue Crystal Structure" 100.00 21 100.00 100.00 1.03e-04 PDB 3ZS2 "Tyrb25,Nmepheb26,Lysb28,Prob29-Insulin Analogue Crystal Structure" 100.00 21 100.00 100.00 1.03e-04 PDB 3ZU1 "Structure Of Lysb29(Nepsilon Omega-Carboxyheptadecanoyl) Des(B30) Human Insulin" 100.00 21 100.00 100.00 1.03e-04 PDB 4A7E "X-Ray Crystal Structure Of Porcine Insulin Flash-Cooled At High Pressure" 100.00 21 100.00 100.00 1.03e-04 PDB 4AIY "R6 Human Insulin Hexamer (Symmetric), Nmr, 'green' Substate, Average Structure" 100.00 21 100.00 100.00 1.03e-04 PDB 4AJX "Ligand Controlled Assembly Of Hexamers, Dihexamers, And Linear Multihexamer Structures By An Engineered Acylated Insulin" 100.00 21 100.00 100.00 1.03e-04 PDB 4AJZ "Ligand Controlled Assembly Of Hexamers, Dihexamers, And Linear Multihexamer Structures By An Engineered Acylated Insulin" 100.00 21 100.00 100.00 1.03e-04 PDB 4AK0 "Ligand Controlled Assembly Of Hexamers, Dihexamers, And Linear Multihexamer Structures By An Engineered Acylated Insulin" 100.00 21 100.00 100.00 1.03e-04 PDB 4AKJ "Ligand Controlled Assembly Of Hexamers, Dihexamers, And Linear Multihexamer Structures By An Engineered Acylated Insulin" 100.00 21 100.00 100.00 1.03e-04 PDB 4CXL "Human Insulin Analogue (d-prob8)-insulin" 100.00 21 100.00 100.00 1.03e-04 PDB 4CXN "Crystal Structure Of Human Insulin Analogue (nme-alab8)- Insulin Crystal Form I" 100.00 21 100.00 100.00 1.03e-04 PDB 4CY7 "Crystal Structure Of Human Insulin Analogue (nme-alab8)- Insulin Crystal Form Ii" 100.00 21 100.00 100.00 1.03e-04 PDB 4EWW "Human Insulin" 100.00 21 100.00 100.00 1.03e-04 PDB 4EWX "Human Insulin" 100.00 21 100.00 100.00 1.03e-04 PDB 4EWZ "Human Insulin" 100.00 21 100.00 100.00 1.03e-04 PDB 4EX0 "Human Insulin" 100.00 21 100.00 100.00 1.03e-04 PDB 4EX1 "Human Insulin" 100.00 21 100.00 100.00 1.03e-04 PDB 4EXX "Human Insulin" 100.00 21 100.00 100.00 1.03e-04 PDB 4EY1 "Human Insulin" 100.00 21 100.00 100.00 1.03e-04 PDB 4EY9 "Human Insulin" 100.00 21 100.00 100.00 1.03e-04 PDB 4EYD "Human Insulin" 100.00 21 100.00 100.00 1.03e-04 PDB 4EYN "Human Insulin" 100.00 21 100.00 100.00 1.03e-04 PDB 4EYP "Human Insulin" 100.00 21 100.00 100.00 1.03e-04 PDB 4F0N "Human Insulin" 100.00 21 100.00 100.00 1.03e-04 PDB 4F0O "Human Insulin" 100.00 21 100.00 100.00 1.03e-04 PDB 4F1A "Human Insulin" 100.00 21 100.00 100.00 1.03e-04 PDB 4F1B "Human Insulin" 100.00 21 100.00 100.00 1.03e-04 PDB 4F1C "Human Insulin" 100.00 21 100.00 100.00 1.03e-04 PDB 4F1D "Human Insulin" 100.00 21 100.00 100.00 1.03e-04 PDB 4F1F "Human Insulin" 100.00 21 100.00 100.00 1.03e-04 PDB 4F1G "Human Insulin" 100.00 21 100.00 100.00 1.03e-04 PDB 4F4T "Human Insulin" 100.00 21 100.00 100.00 1.03e-04 PDB 4F4V "Human Insulin" 100.00 21 100.00 100.00 1.03e-04 PDB 4F51 "Human Insulin" 100.00 21 100.00 100.00 1.03e-04 PDB 4F8F "Human Insulin" 100.00 21 100.00 100.00 1.03e-04 PDB 4FG3 "Crystal Structure Analysis Of The Human Insulin" 100.00 21 100.00 100.00 1.03e-04 PDB 4FKA "High Resolution Structure Of The Manganese Derivative Of Insulin" 100.00 21 100.00 100.00 1.03e-04 PDB 4GBC "Crystal Structure Of Aspart Insulin At Ph 6.5" 100.00 21 100.00 100.00 1.03e-04 PDB 4GBI "Crystal Structure Of Aspart Insulin At Ph 6.5" 100.00 21 100.00 100.00 1.03e-04 PDB 4GBK "Crystal Structure Of Aspart Insulin At Ph 8.5" 100.00 21 100.00 100.00 1.03e-04 PDB 4GBL "Crystal Structure Of Aspart Insulin At Ph 8.5" 100.00 21 100.00 100.00 1.03e-04 PDB 4GBN "Crystal Structure Of Aspart Insulin At Ph 6.5" 100.00 21 100.00 100.00 1.03e-04 PDB 4INS "The Structure Of 2zn Pig Insulin Crystals At 1.5 Angstroms Resolution" 100.00 21 100.00 100.00 1.03e-04 PDB 4IUZ "High Resolution Crystal Structure Of Racemic Ester Insulin" 100.00 21 100.00 100.00 1.03e-04 PDB 4NIB "Crystal Structure Of Human Insulin Mutant B20 D-ala, B23 D-ala" 100.00 21 100.00 100.00 1.03e-04 PDB 4OGA "Insulin In Complex With Site 1 Of The Human Insulin Receptor" 100.00 21 100.00 100.00 1.03e-04 PDB 4P65 "Crystal Structure Of An Cyclohexylalanine Substituted Insulin Analog." 100.00 21 100.00 100.00 1.03e-04 PDB 4UNE "Human Insulin B26phe Mutant Crystal Structure" 100.00 21 100.00 100.00 1.03e-04 PDB 4UNG "Human Insulin B26asn Mutant Crystal Structure" 100.00 21 100.00 100.00 1.03e-04 PDB 4UNH "Human Insulin B26gly Mutant Crystal Structure" 100.00 21 100.00 100.00 1.03e-04 PDB 5AIY "R6 Human Insulin Hexamer (Symmetric), Nmr, 'red' Substate, Average Structure" 100.00 21 100.00 100.00 1.03e-04 PDB 6INS "X-Ray Analysis Of The Single Chain B29-A1 Peptide-Linked Insulin Molecule. A Completely Inactive Analogue" 100.00 50 100.00 100.00 7.80e-05 PDB 7INS "Structure Of Porcine Insulin Cocrystallized With Clupeine Z" 100.00 21 100.00 100.00 1.03e-04 PDB 9INS "Monovalent Cation Binding In Cubic Insulin Crystals" 100.00 21 100.00 100.00 1.03e-04 DBJ BAH59081 "human M-proinsulin [synthetic construct]" 100.00 87 100.00 100.00 3.86e-05 DBJ BAJ17943 "insulin [synthetic construct]" 100.00 110 100.00 100.00 3.91e-05 DBJ BAM29044 "insulin, partial [Suncus murinus]" 100.00 77 100.00 100.00 3.00e-05 EMBL CAA23424 "unnamed protein product [synthetic construct]" 100.00 87 100.00 100.00 3.86e-05 EMBL CAA23475 "preproinsulin [Canis sp.]" 100.00 110 100.00 100.00 2.66e-05 EMBL CAA23828 "preproinsulin [Homo sapiens]" 100.00 110 100.00 100.00 3.91e-05 EMBL CAA43403 "Preproinsulin [Pan troglodytes]" 100.00 110 100.00 100.00 2.43e-05 EMBL CAA43405 "Preproinsulin [Chlorocebus aethiops]" 100.00 110 100.00 100.00 2.66e-05 GB AAA17540 "insulin, partial [Oryctolagus cuniculus]" 100.00 55 100.00 100.00 2.93e-05 GB AAA19033 "insulin [Oryctolagus cuniculus]" 100.00 110 100.00 100.00 2.63e-05 GB AAA36849 "preproinsulin [Macaca fascicularis]" 100.00 110 100.00 100.00 2.51e-05 GB AAA59172 "insulin [Homo sapiens]" 100.00 110 100.00 100.00 3.91e-05 GB AAA59173 "insulin [Homo sapiens]" 100.00 110 100.00 100.00 3.91e-05 PRF 0601246A insulin,prepro 100.00 110 100.00 100.00 3.91e-05 PRF 1006230A insulin,pro- 100.00 86 100.00 100.00 3.83e-05 PRF 550086A insulin 100.00 51 100.00 100.00 7.11e-05 PRF 560164B insulin 100.00 21 100.00 100.00 1.03e-04 PRF 580107B insulin 100.00 50 100.00 100.00 6.74e-05 REF NP_000198 "insulin preproprotein [Homo sapiens]" 100.00 110 100.00 100.00 3.91e-05 REF NP_001008996 "insulin preproprotein [Pan troglodytes]" 100.00 110 100.00 100.00 2.43e-05 REF NP_001075804 "insulin precursor [Oryctolagus cuniculus]" 100.00 110 100.00 100.00 2.63e-05 REF NP_001103242 "insulin precursor [Sus scrofa]" 100.00 108 100.00 100.00 3.77e-05 REF NP_001123565 "insulin precursor [Canis lupus familiaris]" 100.00 110 100.00 100.00 2.66e-05 SP P01308 "RecName: Full=Insulin; Contains: RecName: Full=Insulin B chain; Contains: RecName: Full=Insulin A chain; Flags: Precursor [Homo" 100.00 110 100.00 100.00 3.91e-05 SP P01311 "RecName: Full=Insulin; Contains: RecName: Full=Insulin B chain; Contains: RecName: Full=Insulin A chain; Flags: Precursor [Oryc" 100.00 110 100.00 100.00 2.63e-05 SP P01315 "RecName: Full=Insulin; Contains: RecName: Full=Insulin B chain; Contains: RecName: Full=Insulin A chain; Flags: Precursor [Sus " 100.00 108 100.00 100.00 3.77e-05 SP P01321 "RecName: Full=Insulin; Contains: RecName: Full=Insulin B chain; Contains: RecName: Full=Insulin A chain; Flags: Precursor [Cani" 100.00 110 100.00 100.00 2.66e-05 SP P30406 "RecName: Full=Insulin; Contains: RecName: Full=Insulin B chain; Contains: RecName: Full=Insulin A chain; Flags: Precursor [Maca" 100.00 110 100.00 100.00 2.51e-05 stop_ save_ #################### # Natural source # #################### save_natural_source _Saveframe_category natural_source loop_ _Mol_label _Organism_name_common _NCBI_taxonomy_ID _Superkingdom _Kingdom _Genus _Species _Strain $insulin_A_chain human 9606 Eukaryota Metazoa Homo sapiens generic stop_ save_ ######################### # Experimental source # ######################### save_experimental_source _Saveframe_category experimental_source loop_ _Mol_label _Production_method _Host_organism_name_common _Genus _Species _Strain _Vector_name $insulin_A_chain 'not available' yeast Saccharomyces cerevisiae generic . stop_ save_ ##################################### # Sample contents and methodology # ##################################### ######################## # Sample description # ######################## save_sample_one _Saveframe_category sample _Sample_type solution _Details . save_ ######################### # Experimental detail # ######################### ################################## # NMR Spectrometer definitions # ################################## save_spectrometer_list _Saveframe_category NMR_spectrometer _Manufacturer unknown _Model unknown _Field_strength 0 _Details 'spectrometer information not available' save_ ############################# # NMR applied experiments # ############################# save__1 _Saveframe_category NMR_applied_experiment _Sample_label $sample_one save_ ####################### # Sample conditions # ####################### save_sample_condition_set_one _Saveframe_category sample_conditions _Details . loop_ _Variable_type _Variable_value _Variable_value_error _Variable_value_units pH 7.6 . na temperature 298 . K stop_ save_ #################### # NMR parameters # #################### ############################## # Assigned chemical shifts # ############################## ################################ # Chemical shift referencing # ################################ save_chem_shift_reference_par_set_one _Saveframe_category chemical_shift_reference _Details . loop_ _Mol_common_name _Atom_type _Atom_isotope_number _Atom_group _Chem_shift_units _Chem_shift_value _Reference_method _Reference_type _External_reference_sample_geometry _External_reference_location _External_reference_axis _Indirect_shift_ratio_citation_label _Correction_value_citation_label DSS H . CH3 ppm 0 . . . . . $entry_citation $entry_citation 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 _Saveframe_category assigned_chemical_shifts _Details . loop_ _Sample_label $sample_one stop_ _Sample_conditions_label $sample_condition_set_one _Chem_shift_reference_set_label $chem_shift_reference_par_set_one _Mol_system_component_name 'insulin A chain' _Text_data_format . _Text_data . loop_ _Atom_shift_assign_ID _Residue_author_seq_code _Residue_seq_code _Residue_label _Atom_name _Atom_type _Chem_shift_value _Chem_shift_value_error _Chem_shift_ambiguity_code 1 . 14 TYR HD1 H 7.13 . 1 2 . 14 TYR HD2 H 7.13 . 1 3 . 14 TYR HE1 H 6.82 . 1 4 . 14 TYR HE2 H 6.82 . 1 5 . 19 TYR HD1 H 7.3 . 1 6 . 19 TYR HD2 H 7.3 . 1 7 . 19 TYR HE1 H 6.76 . 1 8 . 19 TYR HE2 H 6.76 . 1 stop_ save_