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3UDD

Tankyrase-1 in complex with small molecule inhibitor

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 A 2001
ChainResidue
ACYS1234
AHIS1237
ACYS1242
ACYS1245

site_idAC2
Number of Residues4
DetailsBINDING SITE FOR RESIDUE ZN B 2001
ChainResidue
BCYS1234
BHIS1237
BCYS1242
BCYS1245

site_idAC3
Number of Residues14
DetailsBINDING SITE FOR RESIDUE 34M A 1
ChainResidue
ASER1186
APRO1187
APHE1188
AALA1191
AILE1192
AGLY1196
APHE1197
AASP1198
AHIS1201
ATYR1203
ATYR1213
AGLY1227
AILE1228
AHIS1184

site_idAC4
Number of Residues17
DetailsBINDING SITE FOR RESIDUE 34M B 1
ChainResidue
BHIS1184
BSER1186
BPRO1187
BPHE1188
BALA1191
BILE1192
BLYS1195
BGLY1196
BPHE1197
BASP1198
BHIS1201
BTYR1203
BILE1212
BTYR1213
BTYR1224
BGLY1227
BILE1228

site_idAC5
Number of Residues6
DetailsBINDING SITE FOR RESIDUE SO4 B 1328
ChainResidue
BHOH138
BHOH296
BARG1130
BHIS1132
BARG1133
BLYS1220

site_idAC6
Number of Residues5
DetailsBINDING SITE FOR RESIDUE SO4 A 2
ChainResidue
AHOH298
AARG1130
AHIS1132
AARG1133
ALYS1220

site_idAC7
Number of Residues5
DetailsBINDING SITE FOR RESIDUE SO4 A 3
ChainResidue
AHOH13
AASN1143
AARG1144
APRO1313
AGLU1314

site_idAC8
Number of Residues3
DetailsBINDING SITE FOR RESIDUE SO4 A 4
ChainResidue
AARG1149
AHIS1246
ATHR1307

site_idAC9
Number of Residues9
DetailsBINDING SITE FOR RESIDUE SO4 A 5
ChainResidue
AHOH240
APHE1183
AHIS1184
AGLY1185
ATYR1213
APHE1214
ALYS1220
ASER1221
ATYR1224

site_idBC1
Number of Residues4
DetailsBINDING SITE FOR RESIDUE SO4 B 6
ChainResidue
BHOH315
BHIS1176
BHIS1177
BASN1178

site_idBC2
Number of Residues5
DetailsBINDING SITE FOR RESIDUE GOL A 7
ChainResidue
AHIS1176
AHIS1177
AASN1178
AGLU1179
BHIS1176

site_idBC3
Number of Residues8
DetailsBINDING SITE FOR RESIDUE GOL A 8
ChainResidue
ALEU1158
AARG1161
APHE1162
AGLY1196
APHE1197
AGLY1297
AGLU1298
AALA1300

site_idBC4
Number of Residues5
DetailsBINDING SITE FOR RESIDUE GOL A 9
ChainResidue
AASN1173
AASN1178
AGLY1257
ALYS1258
ASER1259

site_idBC5
Number of Residues8
DetailsBINDING SITE FOR RESIDUE GOL B 10
ChainResidue
BHOH145
BHOH326
BARG1130
BGLU1131
BHIS1132
BGLY1140
BILE1141
BPHE1142

221051

PDB entries from 2024-06-12

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