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3W1V

Crystal Structure of Capsular Polysaccharide Synthesizing Enzyme CapE from Staphylococcus aureus in complex with inihibitor

Functional Information from GO Data
ChainGOidnamespacecontents
A0000166molecular_functionnucleotide binding
A0003978molecular_functionUDP-glucose 4-epimerase activity
A0009103biological_processlipopolysaccharide biosynthetic process
B0000166molecular_functionnucleotide binding
B0003978molecular_functionUDP-glucose 4-epimerase activity
B0009103biological_processlipopolysaccharide biosynthetic process
Functional Information from PDB Data
site_idAC1
Number of Residues6
DetailsBINDING SITE FOR RESIDUE SO4 A 401
ChainResidue
AARG46
AASN289
ATYR290
ASER291
AHOH571
AHOH642

site_idAC2
Number of Residues6
DetailsBINDING SITE FOR RESIDUE SO4 A 402
ChainResidue
AHOH583
AHOH584
AHOH585
ALEU327
AGLU328
ATYR329

site_idAC3
Number of Residues6
DetailsBINDING SITE FOR RESIDUE SO4 A 403
ChainResidue
AARG62
AASP63
ASER64
AGLN65
AASN106
AHOH593

site_idAC4
Number of Residues8
DetailsBINDING SITE FOR RESIDUE SO4 A 404
ChainResidue
AGLU68
AARG72
AILE112
AHIS113
AHIS113
AGLN114
AHOH567
AHOH670

site_idAC5
Number of Residues4
DetailsBINDING SITE FOR RESIDUE SO4 A 405
ChainResidue
AARG-4
AGLY-3
APRO227
ALYS323

site_idAC6
Number of Residues4
DetailsBINDING SITE FOR RESIDUE SO4 A 406
ChainResidue
AASP284
ASER285
AASN292
AHOH640

site_idAC7
Number of Residues2
DetailsBINDING SITE FOR RESIDUE SO4 A 407
ChainResidue
AASN308
AASN311

site_idAC8
Number of Residues11
DetailsBINDING SITE FOR RESIDUE EPE A 408
ChainResidue
ATYR129
ALYS258
ALYS259
AALA260
AGLU306
AHOH548
AHOH631
BTYR129
BARG266
BGLU306
BHOH560

site_idAC9
Number of Residues26
DetailsBINDING SITE FOR RESIDUE UDZ A 409
ChainResidue
ALYS84
AGLN85
AVAL86
ALYS126
AASN166
ASER170
AARG171
ASER173
AVAL174
ALEU177
ATHR189
AILE190
ATHR191
AMET195
AARG197
AVAL231
AARG254
AGLU257
AHOH530
AHOH605
AHOH635
AHOH665
AHOH671
BTYR293
BHOH576
BHOH652

site_idBC1
Number of Residues6
DetailsBINDING SITE FOR RESIDUE SO4 B 401
ChainResidue
BARG46
BASN289
BTYR290
BSER291
BHOH565
BHOH566

site_idBC2
Number of Residues5
DetailsBINDING SITE FOR RESIDUE SO4 B 402
ChainResidue
BASP284
BSER285
BASN292
BHOH584
BHOH585

site_idBC3
Number of Residues5
DetailsBINDING SITE FOR RESIDUE SO4 B 403
ChainResidue
BARG-4
BGLY-3
BPRO227
BLYS323
BHOH681

site_idBC4
Number of Residues5
DetailsBINDING SITE FOR RESIDUE SO4 B 404
ChainResidue
BLEU327
BGLU328
BTYR329
BHOH570
BHOH656

site_idBC5
Number of Residues5
DetailsBINDING SITE FOR RESIDUE SO4 B 405
ChainResidue
BGLU68
BARG72
BHIS113
BHIS113
BGLN114

site_idBC6
Number of Residues4
DetailsBINDING SITE FOR RESIDUE SO4 B 406
ChainResidue
BILE152
BARG153
BSER154
BARG286

site_idBC7
Number of Residues6
DetailsBINDING SITE FOR RESIDUE SO4 B 407
ChainResidue
BASP73
BASN151
BILE152
BARG153
BGLN156
BHOH630

site_idBC8
Number of Residues6
DetailsBINDING SITE FOR RESIDUE NA B 408
ChainResidue
APRO93
AVAL94
AHOH511
AHOH646
BLYS148
BHOH628

site_idBC9
Number of Residues24
DetailsBINDING SITE FOR RESIDUE UDZ B 409
ChainResidue
ATYR293
BLYS84
BGLN85
BVAL86
BLYS126
BASN166
BSER170
BSER173
BVAL174
BLEU177
BTHR189
BILE190
BTHR191
BMET195
BARG197
BVAL231
BARG254
BGLU257
BHOH539
BHOH559
BHOH564
BHOH614
BHOH615
BHOH685

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PDB entries from 2024-07-10

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