Structure of PDB 5wiz Chain A Binding Site BS01

Receptor Information
>5wiz Chain A (length=311) Species: 293 (Brevundimonas diminuta) [Search protein sequence] [Download receptor structure] [Download structure with residue number starting from 1] [View receptor structure]
RINTVRGPITISEAGFTLTHEHICGSSAGFLRAWPEFFGSRKALAEKAVR
GLRRARAAGVRTIVDVSTFDLGRDVSLLAEVSRAADVHIVAATGLWLDPP
LSMRLRSVEELTQFFLREIQYGIEDTGIRAGIIKVATTGKVTPFQELVLR
AAARASLATGVPVTTHTAASQRGGEQQAAILESEGLSPSRVCIGHSDATD
DLSYLTALAARGYLIGLDSIPHSASWQTRALLIKALIDQGYTKQILVSND
WLFGISSYVTNIMDVMDSGNPDGMAFIPLRVIPFLREKGIPQETLAGITV
TNPARFLSPTL
Ligand information
Ligand IDZN
InChIInChI=1S/Zn/q+2
InChIKeyPTFCDOFLOPIGGS-UHFFFAOYSA-N
SMILES
SoftwareSMILES
CACTVS 3.341[Zn++]
ACDLabs 10.04
OpenEye OEToolkits 1.5.0		[Zn+2]
FormulaZn
NameZINC ION
ChEMBLCHEMBL1236970
DrugBankDB14532
ZINC
PDB chain5wiz Chain A Residue 2401 [Download ligand structure] [Download structure with residue number starting from 1] [View ligand structure]
Receptor-Ligand Complex Structure
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PDB5wiz Phosphotriesterase variant S5
Resolution1.96 Å
Binding residue
(original residue number in PDB)		H55 H57 K169 D301
Binding residue
(residue number reindexed from 1)		H20 H22 K134 D250
Annotation score4
Enzymatic activity
Catalytic site (original residue number in PDB) H55 H57 K169 H201 H230 A233 S254 D301
Catalytic site (residue number reindexed from 1) H20 H22 K134 H166 H195 A198 S219 D250
Enzyme Commision number ?
Gene Ontology
Molecular Function
GO:0008270 zinc ion binding
GO:0016788 hydrolase activity, acting on ester bonds
GO:0046872 metal ion binding
Biological Process
GO:0009056 catabolic process

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Molecular Function
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Biological Process
External links
PDB RCSB:5wiz, PDBe:5wiz, PDBj:5wiz
PDBsum5wiz
PubMed
UniProtA0A060GYS1

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