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5OHH

Crystal structure of human carbonic anhydrase isozyme XIII with 2-[(1S)-2,3-Dihydro-1H-inden-1-ylamino]-3,5,6-trifluoro-4-[(2-hydroxyethyl)thio]benzenesulfonamide

Functional Information from GO Data
ChainGOidnamespacecontents
A0004089molecular_functioncarbonate dehydratase activity
A0005515molecular_functionprotein binding
A0005737cellular_componentcytoplasm
A0005829cellular_componentcytosol
A0006730biological_processone-carbon metabolic process
A0008270molecular_functionzinc ion binding
A0016829molecular_functionlyase activity
A0043209cellular_componentmyelin sheath
A0043231cellular_componentintracellular membrane-bounded organelle
A0046872molecular_functionmetal ion binding
B0004089molecular_functioncarbonate dehydratase activity
B0005515molecular_functionprotein binding
B0005737cellular_componentcytoplasm
B0005829cellular_componentcytosol
B0006730biological_processone-carbon metabolic process
B0008270molecular_functionzinc ion binding
B0016829molecular_functionlyase activity
B0043209cellular_componentmyelin sheath
B0043231cellular_componentintracellular membrane-bounded organelle
B0046872molecular_functionmetal ion binding
Functional Information from PDB Data
site_idAC1
Number of Residues6
Detailsbinding site for residue ZN B 301
ChainResidue
BHIS96
BHIS98
BHIS121
BTHR201
BACT311
BHOH423

site_idAC2
Number of Residues8
Detailsbinding site for residue CIT B 302
ChainResidue
BHIS105
BSER245
BHIS247
BHOH562
BHOH578
AHOH463
BGLY100
BSER101

site_idAC3
Number of Residues7
Detailsbinding site for residue EDO B 303
ChainResidue
BGLN160
BGLN223
BLYS227
BHOH418
BHOH429
BHOH431
BHOH463

site_idAC4
Number of Residues6
Detailsbinding site for residue EDO B 304
ChainResidue
AARG82
AHOH520
BPRO189
BSER190
BHOH439
BHOH518

site_idAC5
Number of Residues9
Detailsbinding site for residue AZI B 305
ChainResidue
BHIS66
BHIS96
BHIS98
BVAL202
B5DU313
BHOH405
BHOH406
BHOH423
BHOH491

site_idAC6
Number of Residues7
Detailsbinding site for residue BCN B 306
ChainResidue
ATYR42
AHIS263
BTYR42
BASP43
BSER44
BHIS263
BHOH514

site_idAC7
Number of Residues6
Detailsbinding site for residue EDO B 307
ChainResidue
ATHR75
AGLU76
BASP103
BILE152
BHOH401
BHOH420

site_idAC8
Number of Residues6
Detailsbinding site for residue EDO B 308
ChainResidue
ATHR75
BSER222
BGLN223
BHOH487
BHOH501
BHOH503

site_idAC9
Number of Residues10
Detailsbinding site for residue PEG B 309
ChainResidue
BLYS36
BGLU39
BLEU253
BLCP310
BHOH435
BHOH459
BHOH472
BHOH530
BHOH565
BHOH700

site_idAD1
Number of Residues4
Detailsbinding site for residue LCP B 310
ChainResidue
BLYS36
BGLN223
BPEG309
BHOH549

site_idAD2
Number of Residues8
Detailsbinding site for residue ACT B 311
ChainResidue
BHIS96
BHIS121
BVAL145
BLEU200
BTHR201
BZN301
B5DU313
BHOH423

site_idAD3
Number of Residues5
Detailsbinding site for residue CIT B 312
ChainResidue
BSER6
BARG10
BGLU11
BHIS12
BASN13

site_idAD4
Number of Residues11
Detailsbinding site for residue 5DU B 313
ChainResidue
ALYS257
BARG93
BGLN94
BHIS96
BVAL123
BPHE133
BVAL202
BPRO204
BAZI305
BACT311
BHOH405

site_idAD5
Number of Residues6
Detailsbinding site for residue ZN A 301
ChainResidue
AHIS96
AHIS98
AHIS121
ATHR201
AACT307
AHOH427

site_idAD6
Number of Residues7
Detailsbinding site for residue PEG A 302
ChainResidue
AASP28
AGLN29
ALYS254
AARG256
BLYS59
BILE60
BARG177

site_idAD7
Number of Residues9
Detailsbinding site for residue EDO A 303
ChainResidue
AILE16
ALYS19
AALA25
AASP26
AGLU154
AGLN251
AHOH424
AHOH494
AHOH503

site_idAD8
Number of Residues7
Detailsbinding site for residue EDO A 304
ChainResidue
AASP43
ASER45
ALEU46
AGLY84
AARG259
AHOH571
AHOH651

site_idAD9
Number of Residues6
Detailsbinding site for residue EDO A 305
ChainResidue
AASP103
AASP104
AILE152
AHOH419
AHOH451
BGLU76

site_idAE1
Number of Residues9
Detailsbinding site for residue CIT A 306
ChainResidue
AGLY100
ASER101
AHIS105
ASER245
AHIS247
AHOH518
AHOH596
AHOH638
AHOH658

site_idAE2
Number of Residues7
Detailsbinding site for residue ACT A 307
ChainResidue
AHIS96
AHIS121
AVAL145
ALEU200
ATHR201
AZN301
AHOH427

site_idAE3
Number of Residues4
Detailsbinding site for residue CIT A 308
ChainResidue
AARG10
AGLU11
AHIS12
AASN13

Functional Information from PROSITE/UniProt
site_idPS00162
Number of Residues17
DetailsALPHA_CA_1 Alpha-carbonic anhydrases signature. SEHiVdgvsYaaELHVV
ChainResidueDetails
BSER107-VAL123

Functional Information from SwissProt/UniProt
site_idSWS_FT_FI1
Number of Residues2
DetailsACT_SITE: Proton donor/acceptor => ECO:0000250|UniProtKB:P00918
ChainResidueDetails
BHIS66
AHIS66

site_idSWS_FT_FI2
Number of Residues6
DetailsBINDING: BINDING => ECO:0000269|PubMed:18618712
ChainResidueDetails
BHIS96
BHIS98
BHIS121
AHIS96
AHIS98
AHIS121

site_idSWS_FT_FI3
Number of Residues2
DetailsBINDING: BINDING => ECO:0000250|UniProtKB:P00918
ChainResidueDetails
BTHR201
ATHR201

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PDB entries from 2024-07-24

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