Structure of PDB 6bh7 Chain A Binding Site BS02

Receptor Information
>6bh7 Chain A (length=308) Species: 293 (Brevundimonas diminuta) [Search protein sequence] [Download receptor structure] [Download structure with residue number starting from 1] [View receptor structure]
RINTVRGPITISEVGFTLTHEHICGSSAGFLRAWPEFFGSREALVEKAVR
GLRRARAAGVRTIVDVSTFDLGRDVRLLAEVSRAADVHIVAATGVWLDPP
LSIRMRSVEELTQFFLREIQYGIEDTGIRAGIIKVAITGKVTPFQELVLR
AAARASLATGVPVITHTAGSQRGGEQQAAIFESEGLSPSRVCIGHSDETD
DLSYLTALAARGYLIGLDSISWQTRALLIKALIDQGYMKQILVSNDWLFG
ISSYVTNFMDVMDSVNPDGMAFIPLRVIPFLREKGIPQETLAGITVTNPA
RFLSPTLR
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 chain6bh7 Chain A Residue 2402 [Download ligand structure] [Download structure with residue number starting from 1] [View ligand structure]
Receptor-Ligand Complex Structure
Global viewLocal viewStructure summary

[Spin on] [Spin off] [Reset]
[High quality] [Low quality]
[White background] [Black background]
[Spin on] [Spin off] [Reset]
[High quality] [Low quality]
[White background] [Black background]
PDB6bh7 Phosphotriesterase variant R18+254S
Resolution1.4 Å
Binding residue
(original residue number in PDB)		K169 H201
Binding residue
(residue number reindexed from 1)		K134 H166
Annotation score4
Enzymatic activity
Catalytic site (original residue number in PDB) H55 H57 K169 H201 H230 E233 S254 D301
Catalytic site (residue number reindexed from 1) H20 H22 K134 H166 H195 E198 S219 D246
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

View graph for
Molecular Function
View graph for
Biological Process
External links
PDB RCSB:6bh7, PDBe:6bh7, PDBj:6bh7
PDBsum6bh7
PubMed
UniProtA0A060GYS7

[Back to BioLiP]