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4BUE

Crystal structure of human tankyrase 2 in complex with 3-methyl-N-(4-(4-oxo-3,4-dihydroquinazolin-2-yl)phenyl)butanamide

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 Residues4
DetailsBINDING SITE FOR RESIDUE ZN B 2162
ChainResidue
BCYS1081
BHIS1084
BCYS1089
BCYS1092

site_idAC2
Number of Residues4
DetailsBINDING SITE FOR RESIDUE ZN A 2162
ChainResidue
ACYS1081
AHIS1084
ACYS1089
ACYS1092

site_idAC3
Number of Residues6
DetailsBINDING SITE FOR RESIDUE GOL A 2163
ChainResidue
ASER1130
AVAL1131
AASN1132
AGLY1133
AHOH3203
APRO1129

site_idAC4
Number of Residues8
DetailsBINDING SITE FOR RESIDUE SO4 A 2164
ChainResidue
AARG977
AHIS979
AARG980
ALYS1067
AGLN1070
AHOH3035
AHOH3040
AHOH3145

site_idAC5
Number of Residues6
DetailsBINDING SITE FOR RESIDUE SO4 B 2163
ChainResidue
BARG977
BHIS979
BARG980
BLYS1067
BGLN1070
BHOH3041

site_idAC6
Number of Residues6
DetailsBINDING SITE FOR RESIDUE SO4 B 2164
ChainResidue
BASN990
BARG991
BPRO1160
BGLU1161
BHOH3054
BHOH3165

site_idAC7
Number of Residues6
DetailsBINDING SITE FOR RESIDUE SO4 A 2165
ChainResidue
AASN990
AARG991
APRO1160
AGLU1161
AHOH3056
AHOH3058

site_idAC8
Number of Residues12
DetailsBINDING SITE FOR RESIDUE JQF B 2165
ChainResidue
BHIS1031
BGLY1032
BPHE1035
BALA1049
BTYR1050
BTYR1060
BLYS1067
BSER1068
BTYR1071
BILE1075
BGLU1138
BHOH3092

site_idAC9
Number of Residues10
DetailsBINDING SITE FOR RESIDUE JQF A 2166
ChainResidue
AHIS1031
AGLY1032
AALA1049
ATYR1050
ATYR1060
ALYS1067
ASER1068
ATYR1071
AGLU1138
AHOH3123

site_idBC1
Number of Residues4
DetailsBINDING SITE FOR RESIDUE PEG A 2167
ChainResidue
AASN1002
ATRP1006
ATYR1148
AGLU1150

site_idBC2
Number of Residues7
DetailsBINDING SITE FOR RESIDUE GOL B 2166
ChainResidue
BHIS979
BGLY982
BILE988
BPHE989
BHOH3035
BHOH3039
BHOH3053

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 2024-07-10

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