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4UVX

Crystal structure of human tankyrase 2 in complex with 3-(4- chlorophenyl)-5-fluoro-1,2-dihydroisoquinolin-1-one

Functional Information from GO Data
ChainGOidnamespacecontents
A0003950molecular_functionNAD+ ADP-ribosyltransferase activity
B0003950molecular_functionNAD+ ADP-ribosyltransferase activity
Functional Information from PDB Data
site_idAC1
Number of Residues6
DetailsBINDING SITE FOR RESIDUE SO4 A 2162
ChainResidue
AARG977
AHIS979
AARG980
ALYS1067
AGLN1070
AHOH2034

site_idAC2
Number of Residues9
DetailsBINDING SITE FOR RESIDUE SO4 B 2162
ChainResidue
BLYS1067
BGLN1070
BHOH2023
BHOH2073
BHOH2099
BHOH2110
BARG977
BHIS979
BARG980

site_idAC3
Number of Residues5
DetailsBINDING SITE FOR RESIDUE SO4 A 2163
ChainResidue
AASN990
AARG991
APRO1160
AGLU1161
AHOH2044

site_idAC4
Number of Residues5
DetailsBINDING SITE FOR RESIDUE SO4 B 2163
ChainResidue
BASN990
BARG991
BPRO1160
BGLU1161
BHOH2031

site_idAC5
Number of Residues6
DetailsBINDING SITE FOR RESIDUE GOL A 2164
ChainResidue
AARG1128
APRO1129
ASER1130
AVAL1131
AASN1132
AGLY1133

site_idAC6
Number of Residues4
DetailsBINDING SITE FOR RESIDUE ZN B 2164
ChainResidue
BCYS1081
BHIS1084
BCYS1089
BCYS1092

site_idAC7
Number of Residues4
DetailsBINDING SITE FOR RESIDUE ZN A 2165
ChainResidue
ACYS1081
AHIS1084
ACYS1089
ACYS1092

site_idAC8
Number of Residues11
DetailsBINDING SITE FOR RESIDUE H2W B 2165
ChainResidue
BHIS1031
BGLY1032
BSER1033
BPHE1035
BTYR1050
BTYR1060
BALA1062
BLYS1067
BSER1068
BTYR1071
BGLU1138

site_idAC9
Number of Residues9
DetailsBINDING SITE FOR RESIDUE H2W A 2166
ChainResidue
AHIS1031
AGLY1032
ASER1033
ATYR1050
ATYR1060
ALYS1067
ASER1068
ATYR1071
AGLU1138

site_idBC1
Number of Residues7
DetailsBINDING SITE FOR RESIDUE GOL A 2167
ChainResidue
AARG977
AHIS979
AGLY983
AGLY987
AILE988
APHE989
AHOH2043

Functional Information from SwissProt/UniProt
site_idSWS_FT_FI1
Number of Residues8
DetailsBINDING: BINDING => ECO:0000250|UniProtKB:O95271
ChainResidueDetails
ACYS1081
AHIS1084
ACYS1089
ACYS1092
BCYS1081
BHIS1084
BCYS1089
BCYS1092

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PDB entries from 2024-04-24

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