eF-site ID 6nrh-A PDB Code 6nrh Chain A click to enlarge Title Crystal Structure of human PARP-1 ART domain bound inhibitor UTT63 Classification transferase/transferase inhibitor Compound Poly [ADP-ribose] polymerase 1 Source (PARP1_HUMAN) Sequence A:  KSKLPKPVQDLIKMIFGDPIDVNYEKLKTDIKVVDRDSEE AEIIRKYVKNTHATTHNAYDLEVIDIFKIEREGECQRYKP FKQLHNRRLLWHGSRTTNFAGILSQGLRIAPPEAPVTGYM FGKGIYFADMVSKSANYCHTSQGDPIGLILLGEVALGNMY ELKHASHISKLPKGKHSVKGLGKTTPDPSANISLDGVDVP LGTGISSGVNDTSLLYNEYIVYDIAQVNLKYLLKLKFNFK Description Functional site 1) chain A residue 862 type sequence H description binding site for residue KYP A 1101 source : AC1 2) chain A residue 863 type sequence G description binding site for residue KYP A 1101 source : AC1 3) chain A residue 868 type sequence N description binding site for residue KYP A 1101 source : AC1 4) chain A residue 888 type sequence G description binding site for residue KYP A 1101 source : AC1 5) chain A residue 889 type sequence Y description binding site for residue KYP A 1101 source : AC1 6) chain A residue 896 type sequence Y description binding site for residue KYP A 1101 source : AC1 7) chain A residue 897 type sequence F description binding site for residue KYP A 1101 source : AC1 8) chain A residue 904 type sequence S description binding site for residue KYP A 1101 source : AC1 9) chain A residue 907 type sequence Y description binding site for residue KYP A 1101 source : AC1 10) chain A residue 766 type sequence K description binding site for residue SO4 A 1102 source : AC2 11) chain A residue 903 type sequence K description binding site for residue SO4 A 1102 source : AC2 12) chain A residue 984 type sequence L description binding site for residue SO4 A 1102 source : AC2 13) chain A residue 985 type sequence L description binding site for residue SO4 A 1102 source : AC2 14) chain A residue 986 type sequence Y description binding site for residue SO4 A 1102 source : AC2 15) chain A residue 806 type sequence R description binding site for residue SO4 A 1103 source : AC3 16) chain A residue 953 type sequence K description binding site for residue SO4 A 1103 source : AC3 17) chain A residue 980 type sequence N description binding site for residue SO4 A 1103 source : AC3 18) chain A residue 981 type sequence D description binding site for residue SO4 A 1103 source : AC3 19) chain A residue 982 type sequence T description binding site for residue SO4 A 1103 source : AC3 20) chain A residue 849 type sequence K description binding site for residue SO4 A 1104 source : AC4 21) chain A residue 998 type sequence N description binding site for residue SO4 A 1104 source : AC4 22) chain A residue 1000 type sequence K description binding site for residue SO4 A 1104 source : AC4 23) chain A residue 858 type sequence R description binding site for residue SO4 A 1105 source : AC5 24) chain A residue 929 type sequence M description binding site for residue SO4 A 1105 source : AC5 25) chain A residue 949 type sequence K description binding site for residue SO4 A 1105 source : AC5 26) chain A residue 906 type sequence N description binding site for residue SO4 A 1106 source : AC6 27) chain A residue 907 type sequence Y description binding site for residue SO4 A 1106 source : AC6 28) chain A residue 862 type sequence H description binding site for residue DMS A 1107 source : AC7 29) chain A residue 878 type sequence R description binding site for residue DMS A 1107 source : AC7 30) chain A residue 889 type sequence Y description binding site for residue DMS A 1107 source : AC7 31) chain A residue 894 type sequence G description binding site for residue DMS A 1107 source : AC7 32) chain A residue 895 type sequence I description binding site for residue DMS A 1107 source : AC7 33) chain A residue 896 type sequence Y description binding site for residue DMS A 1107 source : AC7 34) chain A residue 798 type sequence K description binding site for residue DMS A 1108 source : AC8 35) chain A residue 799 type sequence T description binding site for residue DMS A 1108 source : AC8 36) chain A residue 883 type sequence E description binding site for residue DMS A 1108 source : AC8 37) chain A residue 884 type sequence A description binding site for residue DMS A 1108 source : AC8 38) chain A residue 885 type sequence P description binding site for residue DMS A 1108 source : AC8 39) chain A residue 988 type ACT_SITE sequence E description For poly [ADP-ribose] polymerase activity => ECO:0000305|PubMed:32028527, ECO:0000305|PubMed:7852410, ECO:0000305|PubMed:9315851 source Swiss-Prot : SWS_FT_FI1 40) chain A residue 862 type BINDING sequence H description BINDING => ECO:0000250|UniProtKB:Q9UGN5 source Swiss-Prot : SWS_FT_FI2 41) chain A residue 871 type BINDING sequence G description BINDING => ECO:0000250|UniProtKB:Q9UGN5 source Swiss-Prot : SWS_FT_FI2 42) chain A residue 878 type BINDING sequence R description BINDING => ECO:0000250|UniProtKB:Q9UGN5 source Swiss-Prot : SWS_FT_FI2 43) chain A residue 904 type BINDING sequence S description BINDING => ECO:0000250|UniProtKB:Q9UGN5 source Swiss-Prot : SWS_FT_FI2

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