eF-site ID 1hdb-D PDB Code 1hdb Chain D click to enlarge Title ANALYSIS OF THE CRYSTAL STRUCTURE, MOLECULAR MODELING AND INFRARED SPECTROSCOPY OF THE DISTAL BETA-HEME POCKET VALINE67(E11)-THREONINE MUTATION OF HEMOGLOBIN Classification OXYGEN TRANSPORT Compound HEMOGLOBIN (DEOXY) BETA-V67T Source Homo sapiens (Human) (HBB_HUMAN) Sequence D:  VHLTPEEKSAVTALWGKVNVDEVGGEALGRLLVVYPWTQR FFESFGDLSTPDAVMGNPKVKAHGKKTLGAFSDGLAHLDN LKGTFATLSELHCDKLHVDPENFRLLGNVLVCVLAHHFGK EFTPPVQAAYQKVVAGVANALAHKYH Description Functional site 1) chain D residue 1 type sequence V description BINDING SITE FOR RESIDUE SO4 D 147 source : AC1 2) chain D residue 79 type sequence D description BINDING SITE FOR RESIDUE SO4 D 147 source : AC1 3) chain D residue 80 type sequence N description BINDING SITE FOR RESIDUE SO4 D 147 source : AC1 4) chain D residue 81 type sequence L description BINDING SITE FOR RESIDUE SO4 D 147 source : AC1 5) chain D residue 82 type sequence K description BINDING SITE FOR RESIDUE SO4 D 147 source : AC1 6) chain D residue 41 type sequence F description BINDING SITE FOR RESIDUE HEM D 148 source : AC6 7) chain D residue 63 type sequence H description BINDING SITE FOR RESIDUE HEM D 148 source : AC6 8) chain D residue 67 type sequence T description BINDING SITE FOR RESIDUE HEM D 148 source : AC6 9) chain D residue 92 type sequence H description BINDING SITE FOR RESIDUE HEM D 148 source : AC6 10) chain D residue 96 type sequence L description BINDING SITE FOR RESIDUE HEM D 148 source : AC6 11) chain D residue 98 type sequence V description BINDING SITE FOR RESIDUE HEM D 148 source : AC6 12) chain D residue 102 type sequence N description BINDING SITE FOR RESIDUE HEM D 148 source : AC6 13) chain D residue 141 type sequence L description BINDING SITE FOR RESIDUE HEM D 148 source : AC6 14) chain D residue 2 type CARBOHYD sequence H description N-linked (Glc) (glycation) valine; in Hb A1c => ECO:0000269|PubMed:635569 source Swiss-Prot : SWS_FT_FI12 15) chain D residue 9 type CARBOHYD sequence S description N-linked (Glc) (glycation) lysine => ECO:0000269|PubMed:7358733 source Swiss-Prot : SWS_FT_FI13 16) chain D residue 18 type CARBOHYD sequence V description N-linked (Glc) (glycation) lysine => ECO:0000269|PubMed:7358733 source Swiss-Prot : SWS_FT_FI13 17) chain D residue 67 type CARBOHYD sequence T description N-linked (Glc) (glycation) lysine => ECO:0000269|PubMed:7358733 source Swiss-Prot : SWS_FT_FI13 18) chain D residue 121 type CARBOHYD sequence E description N-linked (Glc) (glycation) lysine => ECO:0000269|PubMed:7358733 source Swiss-Prot : SWS_FT_FI13 19) chain D residue 145 type CARBOHYD sequence Y description N-linked (Glc) (glycation) lysine; alternate => ECO:0000269|PubMed:7358733 source Swiss-Prot : SWS_FT_FI14 20) chain D residue 2 type MOD_RES sequence H description N-pyruvate 2-iminyl-valine; in Hb A1b source Swiss-Prot : SWS_FT_FI3 21) chain D residue 13 type MOD_RES sequence A description Phosphothreonine => ECO:0007744|PubMed:24275569 source Swiss-Prot : SWS_FT_FI4 22) chain D residue 51 type MOD_RES sequence P description Phosphothreonine => ECO:0007744|PubMed:24275569 source Swiss-Prot : SWS_FT_FI4 23) chain D residue 88 type MOD_RES sequence L description Phosphothreonine => ECO:0007744|PubMed:24275569 source Swiss-Prot : SWS_FT_FI4 24) chain D residue 45 type MOD_RES sequence F description Phosphoserine => ECO:0007744|PubMed:24275569 source Swiss-Prot : SWS_FT_FI5 25) chain D residue 10 type MOD_RES sequence A description Phosphoserine => ECO:0007744|PubMed:24275569 source Swiss-Prot : SWS_FT_FI5 26) chain D residue 60 type MOD_RES sequence V description N6-acetyllysine => ECO:0000269|PubMed:4531009 source Swiss-Prot : SWS_FT_FI6 27) chain D residue 83 type MOD_RES sequence G description N6-acetyllysine => ECO:0000269|PubMed:4531009 source Swiss-Prot : SWS_FT_FI6 28) chain D residue 94 type MOD_RES sequence D description S-nitrosocysteine => ECO:0000269|PubMed:8637569, ECO:0000269|PubMed:9843411 source Swiss-Prot : SWS_FT_FI7 29) chain D residue 2 type BINDING sequence H description source Swiss-Prot : SWS_FT_FI9 30) chain D residue 3 type BINDING sequence L description source Swiss-Prot : SWS_FT_FI9 31) chain D residue 83 type BINDING sequence G description source Swiss-Prot : SWS_FT_FI9 32) chain D residue 144 type BINDING sequence K description source Swiss-Prot : SWS_FT_FI9 33) chain D residue 145 type MOD_RES sequence Y description N6-acetyllysine; alternate => ECO:0000269|PubMed:4531009 source Swiss-Prot : SWS_FT_FI8 34) chain D residue 8 type SITE sequence K description (Microbial infection) Cleavage; by N.americanus apr-2 => ECO:0000269|PubMed:12552433 source Swiss-Prot : SWS_FT_FI10 35) chain D residue 26 type SITE sequence E description (Microbial infection) Cleavage; by N.americanus apr-2 => ECO:0000269|PubMed:12552433 source Swiss-Prot : SWS_FT_FI10 36) chain D residue 30 type SITE sequence R description (Microbial infection) Cleavage; by N.americanus apr-2 => ECO:0000269|PubMed:12552433 source Swiss-Prot : SWS_FT_FI10 37) chain D residue 36 type SITE sequence P description (Microbial infection) Cleavage; by N.americanus apr-2 => ECO:0000269|PubMed:12552433 source Swiss-Prot : SWS_FT_FI10 38) chain D residue 38 type SITE sequence T description (Microbial infection) Cleavage; by N.americanus apr-2 => ECO:0000269|PubMed:12552433 source Swiss-Prot : SWS_FT_FI10 39) chain D residue 46 type SITE sequence G description (Microbial infection) Cleavage; by N.americanus apr-2 => ECO:0000269|PubMed:12552433 source Swiss-Prot : SWS_FT_FI10 40) chain D residue 53 type SITE sequence A description (Microbial infection) Cleavage; by N.americanus apr-2 => ECO:0000269|PubMed:12552433 source Swiss-Prot : SWS_FT_FI10 41) chain D residue 57 type SITE sequence N description (Microbial infection) Cleavage; by N.americanus apr-2 => ECO:0000269|PubMed:12552433 source Swiss-Prot : SWS_FT_FI10 42) chain D residue 72 type SITE sequence S description (Microbial infection) Cleavage; by N.americanus apr-2 => ECO:0000269|PubMed:12552433 source Swiss-Prot : SWS_FT_FI10 43) chain D residue 75 type SITE sequence L description (Microbial infection) Cleavage; by N.americanus apr-2 => ECO:0000269|PubMed:12552433 source Swiss-Prot : SWS_FT_FI10 44) chain D residue 85 type SITE sequence F description (Microbial infection) Cleavage; by N.americanus apr-2 => ECO:0000269|PubMed:12552433 source Swiss-Prot : SWS_FT_FI10 45) chain D residue 93 type SITE sequence C description (Microbial infection) Cleavage; by N.americanus apr-2 => ECO:0000269|PubMed:12552433 source Swiss-Prot : SWS_FT_FI10 46) chain D residue 105 type SITE sequence L description (Microbial infection) Cleavage; by N.americanus apr-2 => ECO:0000269|PubMed:12552433 source Swiss-Prot : SWS_FT_FI10 47) chain D residue 111 type SITE sequence V description (Microbial infection) Cleavage; by N.americanus apr-2 => ECO:0000269|PubMed:12552433 source Swiss-Prot : SWS_FT_FI10 48) chain D residue 120 type SITE sequence K description (Microbial infection) Cleavage; by N.americanus apr-2 => ECO:0000269|PubMed:12552433 source Swiss-Prot : SWS_FT_FI10 49) chain D residue 123 type SITE sequence T description (Microbial infection) Cleavage; by N.americanus apr-2 => ECO:0000269|PubMed:12552433 source Swiss-Prot : SWS_FT_FI10 50) chain D residue 129 type SITE sequence A description (Microbial infection) Cleavage; by N.americanus apr-2 => ECO:0000269|PubMed:12552433 source Swiss-Prot : SWS_FT_FI10 51) chain D residue 141 type SITE sequence L description (Microbial infection) Cleavage; by N.americanus apr-2 => ECO:0000269|PubMed:12552433 source Swiss-Prot : SWS_FT_FI10 52) chain D residue 145 type SITE sequence Y description (Microbial infection) Cleavage; by N.americanus apr-2 => ECO:0000269|PubMed:12552433 source Swiss-Prot : SWS_FT_FI10 53) chain D residue 60 type SITE sequence V description Not glycated => ECO:0000269|PubMed:7358733 source Swiss-Prot : SWS_FT_FI11 54) chain D residue 83 type SITE sequence G description Not glycated => ECO:0000269|PubMed:7358733 source Swiss-Prot : SWS_FT_FI11 55) chain D residue 96 type SITE sequence L description Not glycated => ECO:0000269|PubMed:7358733 source Swiss-Prot : SWS_FT_FI11 56) chain D residue 64 type BINDING sequence G description distal binding residue source Swiss-Prot : SWS_FT_FI1 57) chain D residue 93 type BINDING sequence C description proximal binding residue source Swiss-Prot : SWS_FT_FI2

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