eF-site ID 6chh-A PDB Code 6chh Chain A 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 A:  SSGLVPRGSMESGFTSKDTYLSHFNPRDYLEKYYKSRHSA ESQILKHLLKNLFKIFCLDGVKGDLLIDIGSGPTIYQLLS ACESFKEIVVTDYSDQNLQELEKWLKAAPAAFDWSPVVTY VCDLEGNRVKGPEKEEKLRQAVKQVLKCDVTQSQPLGAVP LPPADCVLSTLCLDAACPDLPTYCRALRNLGSLLKPGGFL VIMDALKSSYYMIGEQKFSSLPLGREAVEAAVKEAGYTIE WFEVISQSYSSTMANNEGLFSLVARKLSR Description Functional site 1) chain A residue 11 type sequence Y description binding site for residue F0P A 301 source : AC1 2) chain A residue 20 type sequence Y description binding site for residue F0P A 301 source : AC1 3) chain A residue 25 type sequence Y description binding site for residue F0P A 301 source : AC1 4) chain A residue 63 type sequence G description binding site for residue F0P A 301 source : AC1 5) chain A residue 64 type sequence S description binding site for residue F0P A 301 source : AC1 6) chain A residue 65 type sequence G description binding site for residue F0P A 301 source : AC1 7) chain A residue 67 type sequence T description binding site for residue F0P A 301 source : AC1 8) chain A residue 69 type sequence Y description binding site for residue F0P A 301 source : AC1 9) chain A residue 70 type sequence Q description binding site for residue F0P A 301 source : AC1 10) chain A residue 85 type sequence D description binding site for residue F0P A 301 source : AC1 11) chain A residue 86 type sequence Y description binding site for residue F0P A 301 source : AC1 12) chain A residue 90 type sequence N description binding site for residue F0P A 301 source : AC1 13) chain A residue 141 type sequence C description binding site for residue F0P A 301 source : AC1 14) chain A residue 142 type sequence D description binding site for residue F0P A 301 source : AC1 15) chain A residue 143 type sequence V description binding site for residue F0P A 301 source : AC1 16) chain A residue 163 type sequence T description binding site for residue F0P A 301 source : AC1 17) chain A residue 164 type sequence L description binding site for residue F0P A 301 source : AC1 18) chain A residue 167 type sequence D description binding site for residue F0P A 301 source : AC1 19) chain A residue 168 type sequence A description binding site for residue F0P A 301 source : AC1 20) chain A residue 169 type sequence A description binding site for residue F0P A 301 source : AC1 21) chain A residue 201 type sequence S description binding site for residue F0P A 301 source : AC1 22) chain A residue 204 type sequence Y description binding site for residue F0P A 301 source : AC1 23) chain A residue 213 type sequence S description binding site for residue F0P A 301 source : AC1 24) chain A residue 59-75 type prosite sequence LIDIGSGPTIYQLLSAC description NNMT_PNMT_TEMT NNMT/PNMT/TEMT family of methyltransferases signature. LIDIGSGPTIYQLLSAC source prosite : PS01100 25) chain A residue 20 type BINDING sequence Y description BINDING => ECO:0000269|PubMed:21823666, ECO:0000269|Ref.12 source Swiss-Prot : SWS_FT_FI1 26) chain A residue 25 type BINDING sequence Y description BINDING => ECO:0000269|PubMed:21823666, ECO:0000269|Ref.12 source Swiss-Prot : SWS_FT_FI1 27) chain A residue 63 type BINDING sequence G description BINDING => ECO:0000269|PubMed:21823666, ECO:0000269|Ref.12 source Swiss-Prot : SWS_FT_FI1 28) chain A residue 69 type BINDING sequence Y description BINDING => ECO:0000269|PubMed:21823666, ECO:0000269|Ref.12 source Swiss-Prot : SWS_FT_FI1 29) chain A residue 85 type BINDING sequence D description BINDING => ECO:0000269|PubMed:21823666, ECO:0000269|Ref.12 source Swiss-Prot : SWS_FT_FI1 30) chain A residue 90 type BINDING sequence N description BINDING => ECO:0000269|PubMed:21823666, ECO:0000269|Ref.12 source Swiss-Prot : SWS_FT_FI1 31) chain A residue 142 type BINDING sequence D description BINDING => ECO:0000269|PubMed:21823666, ECO:0000269|Ref.12 source Swiss-Prot : SWS_FT_FI1 32) chain A residue 163 type BINDING sequence T description BINDING => ECO:0000269|PubMed:21823666, ECO:0000269|Ref.12 source Swiss-Prot : SWS_FT_FI1 33) chain A residue 197 type BINDING sequence D description BINDING => ECO:0000269|PubMed:21823666 source Swiss-Prot : SWS_FT_FI2 34) chain A residue 213 type BINDING sequence S description BINDING => ECO:0000269|PubMed:21823666 source Swiss-Prot : SWS_FT_FI2 35) chain A residue 18 type MOD_RES sequence R description Citrulline; alternate => ECO:0000269|PubMed:30044909 source Swiss-Prot : SWS_FT_FI3 36) chain A residue 132 type MOD_RES sequence R description Citrulline; alternate => ECO:0000269|PubMed:30044909 source Swiss-Prot : SWS_FT_FI3 37) chain A residue 181 type MOD_RES sequence R description Citrulline; alternate => ECO:0000269|PubMed:30044909 source Swiss-Prot : SWS_FT_FI3 38) chain A residue 39 type MOD_RES sequence K description N6-acetyllysine => ECO:0007744|PubMed:19608861 source Swiss-Prot : SWS_FT_FI4

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