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5NVH

Crystal structure of TNKS2 in complex with 2-[4-(piperidin-1-yl)phenyl]-3,4-dihydroquinazolin-4-one

Functional Information from GO Data
ChainGOidnamespacecontents
A0003950molecular_functionNAD+ ADP-ribosyltransferase activity
B0003950molecular_functionNAD+ ADP-ribosyltransferase activity
I0003950molecular_functionNAD+ ADP-ribosyltransferase activity
J0003950molecular_functionNAD+ ADP-ribosyltransferase activity
Functional Information from PDB Data
site_idAC1
Number of Residues8
Detailsbinding site for residue SO4 A 1201
ChainResidue
AARG977
AHIS979
AARG980
ALYS1067
AGLN1070
AHOH1327
IHOH1306
IHOH1308

site_idAC2
Number of Residues6
Detailsbinding site for residue SO4 A 1202
ChainResidue
AARG991
AHOH1366
IPRO1160
IGLU1161
IHOH1304
AASN990

site_idAC3
Number of Residues4
Detailsbinding site for residue ZN A 1203
ChainResidue
ACYS1081
AHIS1084
ACYS1089
ACYS1092

site_idAC4
Number of Residues10
Detailsbinding site for residue 9B2 A 1204
ChainResidue
AHIS1031
AGLY1032
AARG1047
ATYR1050
ATYR1060
ALYS1067
ASER1068
ATYR1071
AHOH1398
IGLU1138

site_idAC5
Number of Residues5
Detailsbinding site for residue GOL I 1201
ChainResidue
IPRO1129
IVAL1131
IASN1132
IGLY1133
IGLY1133

site_idAC6
Number of Residues4
Detailsbinding site for residue PEG I 1202
ChainResidue
ALYS999
AASN1002
ATRP1006
IGLU1150

site_idAC7
Number of Residues6
Detailsbinding site for residue SO4 B 1201
ChainResidue
BARG977
BHIS979
BARG980
BLYS1067
BGLN1070
JHOH1214

site_idAC8
Number of Residues5
Detailsbinding site for residue SO4 B 1202
ChainResidue
BASN990
BARG991
JPRO1160
JGLU1161
JHOH1205

site_idAC9
Number of Residues4
Detailsbinding site for residue ZN B 1203
ChainResidue
BCYS1081
BHIS1084
BCYS1089
BCYS1092

site_idAD1
Number of Residues12
Detailsbinding site for residue 9B2 B 1204
ChainResidue
BHIS1031
BGLY1032
BPHE1035
BARG1047
BTYR1050
BTYR1060
BLYS1067
BSER1068
BTYR1071
BILE1075
BHOH1367
JGLU1138

site_idAD2
Number of Residues8
Detailsbinding site for residue GOL B 1205
ChainResidue
BGLU978
BHIS979
BGLY982
BGLY983
BILE988
BPHE989
BHOH1319
BHOH1373

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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