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6QWC

Crystal structure of KPC-4 complexed with relebactam (1 hour soak)

Functional Information from GO Data
ChainGOidnamespacecontents
A0008800molecular_functionbeta-lactamase activity
A0016787molecular_functionhydrolase activity
A0017001biological_processantibiotic catabolic process
A0030655biological_processbeta-lactam antibiotic catabolic process
A0046677biological_processresponse to antibiotic
Functional Information from PDB Data
site_idAC1
Number of Residues6
Detailsbinding site for residue SO4 A 301
ChainResidue
ASER275
AGLU276
AALA277
AHOH402
AHOH466
AHOH507

site_idAC2
Number of Residues5
Detailsbinding site for residue SO4 A 302
ChainResidue
AHOH408
AHOH411
AGLY239
ALYS273
AHIS274

site_idAC3
Number of Residues4
Detailsbinding site for residue SO4 A 303
ChainResidue
AGLN86
AARG104
ATRP105
AHOH446

site_idAC4
Number of Residues7
Detailsbinding site for residue SO4 A 304
ChainResidue
AGLN86
AGLN87
AALA88
AARG104
ATRP105
AMK7310
AHOH414

site_idAC5
Number of Residues5
Detailsbinding site for residue SO4 A 305
ChainResidue
AASP92
AARG178
AHOH459
AHOH509
AHOH565

site_idAC6
Number of Residues10
Detailsbinding site for residue SO4 A 306
ChainResidue
AILE173
AILE173
ATYR241
ATYR241
ALYS270
ALYS270
AHOH416
AHOH416
AHOH484
AHOH484

site_idAC7
Number of Residues6
Detailsbinding site for residue SO4 A 307
ChainResidue
ATHR26
AARG184
APRO226
AALA227
AHOH405
AHOH514

site_idAC8
Number of Residues8
Detailsbinding site for residue SO4 A 308
ChainResidue
AILE108
ATYR112
AMET117
AGLU121
AALA146
AASP163
AHOH410
AHOH550

site_idAC9
Number of Residues5
Detailsbinding site for residue GOL A 309
ChainResidue
AGLN205
ALYS212
AALA230
ATRP251
AHOH485

site_idAD1
Number of Residues18
Detailsbinding site for residue MK7 A 310
ChainResidue
ACYS69
ASER70
ALYS73
AALA88
ATRP105
ASER130
AASN132
ATHR216
ALYS234
ATHR235
AGLY236
ATHR237
ACYS238
ASO4304
AHOH417
AHOH438
AHOH486
AHOH531

Functional Information from SwissProt/UniProt
site_idSWS_FT_FI1
Number of Residues1
DetailsACT_SITE: Acyl-ester intermediate => ECO:0000250
ChainResidueDetails
ASER70

site_idSWS_FT_FI2
Number of Residues1
DetailsACT_SITE: Proton acceptor => ECO:0000250
ChainResidueDetails
AGLU168

site_idSWS_FT_FI3
Number of Residues1
DetailsBINDING: BINDING => ECO:0000250
ChainResidueDetails
ALYS234

223166

PDB entries from 2024-07-31

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