eF-site ID 6chh-D PDB Code 6chh Chain D click to enlarge Title Structure of human NNMT in complex with bisubstrate inhibitor MS2756 Classification TRANSFERASE/TRANSFERASE INHIBITOR Compound Nicotinamide N-methyltransferase Source (NNMT_HUMAN) Sequence D:  NPRDYLEKYYKRHSAESQILKHLLKNLFKIFCLDGVKGDL LIDIGSGPTIYQLLSACESFKEIVVTDYSDQNLQELEKWL KAAPAAFDWSPVVTYVCDLEGNRVKGPEKEEKLRQAVKQV LKCDVTQSQPLGAVPLPPADCVLSTLCLDAACPDLPTYCR ALRNLGSLLKPGGFLVIMDALKSSYYMIGEQKFSSLPLGR EAVEAAVKEAGYTIEWFEVISQSYSSTMANNEGLFSLVAR KLS Description Functional site 1) chain D residue 20 type sequence Y description binding site for residue F0P D 301 source : AC6 2) chain D residue 24 type sequence Y description binding site for residue F0P D 301 source : AC6 3) chain D residue 25 type sequence Y description binding site for residue F0P D 301 source : AC6 4) chain D residue 63 type sequence G description binding site for residue F0P D 301 source : AC6 5) chain D residue 64 type sequence S description binding site for residue F0P D 301 source : AC6 6) chain D residue 65 type sequence G description binding site for residue F0P D 301 source : AC6 7) chain D residue 67 type sequence T description binding site for residue F0P D 301 source : AC6 8) chain D residue 69 type sequence Y description binding site for residue F0P D 301 source : AC6 9) chain D residue 70 type sequence Q description binding site for residue F0P D 301 source : AC6 10) chain D residue 85 type sequence D description binding site for residue F0P D 301 source : AC6 11) chain D residue 86 type sequence Y description binding site for residue F0P D 301 source : AC6 12) chain D residue 90 type sequence N description binding site for residue F0P D 301 source : AC6 13) chain D residue 141 type sequence C description binding site for residue F0P D 301 source : AC6 14) chain D residue 142 type sequence D description binding site for residue F0P D 301 source : AC6 15) chain D residue 143 type sequence V description binding site for residue F0P D 301 source : AC6 16) chain D residue 163 type sequence T description binding site for residue F0P D 301 source : AC6 17) chain D residue 164 type sequence L description binding site for residue F0P D 301 source : AC6 18) chain D residue 167 type sequence D description binding site for residue F0P D 301 source : AC6 19) chain D residue 169 type sequence A description binding site for residue F0P D 301 source : AC6 20) chain D residue 201 type sequence S description binding site for residue F0P D 301 source : AC6 21) chain D residue 204 type sequence Y description binding site for residue F0P D 301 source : AC6 22) chain D residue 213 type sequence S description binding site for residue F0P D 301 source : AC6 23) chain D residue 242 type sequence Y description binding site for residue F0P D 301 source : AC6 24) chain D residue 20 type BINDING sequence Y description BINDING => ECO:0000269|PubMed:21823666, ECO:0000269|Ref.12 source Swiss-Prot : SWS_FT_FI1 25) chain D residue 25 type BINDING sequence Y description BINDING => ECO:0000269|PubMed:21823666, ECO:0000269|Ref.12 source Swiss-Prot : SWS_FT_FI1 26) chain D residue 63 type BINDING sequence G description BINDING => ECO:0000269|PubMed:21823666, ECO:0000269|Ref.12 source Swiss-Prot : SWS_FT_FI1 27) chain D residue 69 type BINDING sequence Y description BINDING => ECO:0000269|PubMed:21823666, ECO:0000269|Ref.12 source Swiss-Prot : SWS_FT_FI1 28) chain D residue 85 type BINDING sequence D description BINDING => ECO:0000269|PubMed:21823666, ECO:0000269|Ref.12 source Swiss-Prot : SWS_FT_FI1 29) chain D residue 90 type BINDING sequence N description BINDING => ECO:0000269|PubMed:21823666, ECO:0000269|Ref.12 source Swiss-Prot : SWS_FT_FI1 30) chain D residue 142 type BINDING sequence D description BINDING => ECO:0000269|PubMed:21823666, ECO:0000269|Ref.12 source Swiss-Prot : SWS_FT_FI1 31) chain D residue 163 type BINDING sequence T description BINDING => ECO:0000269|PubMed:21823666, ECO:0000269|Ref.12 source Swiss-Prot : SWS_FT_FI1 32) chain D residue 197 type BINDING sequence D description BINDING => ECO:0000269|PubMed:21823666 source Swiss-Prot : SWS_FT_FI2 33) chain D residue 213 type BINDING sequence S description BINDING => ECO:0000269|PubMed:21823666 source Swiss-Prot : SWS_FT_FI2 34) chain D residue 18 type MOD_RES sequence R description Citrulline; alternate => ECO:0000269|PubMed:30044909 source Swiss-Prot : SWS_FT_FI3 35) chain D residue 132 type MOD_RES sequence R description Citrulline; alternate => ECO:0000269|PubMed:30044909 source Swiss-Prot : SWS_FT_FI3 36) chain D residue 181 type MOD_RES sequence R description Citrulline; alternate => ECO:0000269|PubMed:30044909 source Swiss-Prot : SWS_FT_FI3 37) chain D residue 39 type MOD_RES sequence K description N6-acetyllysine => ECO:0007744|PubMed:19608861 source Swiss-Prot : SWS_FT_FI4

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