Structure of PDB 5w7h Chain B Binding Site BS01

Receptor Information
>5w7h Chain B (length=329) Species: 358 (Agrobacterium tumefaciens) [Search protein sequence] [Download receptor structure] [Download structure with residue number starting from 1] [View receptor structure]
TGDLINTVRGPIPVSEAGFTLTHEHICGSSAGFLRAWPEFFGSRKALVEK
AVRGLRHARAAGVQTIVDVSTFDIGRDVRLLAEVSRAADVHIVAATGLWF
DPPLSMRMRSVEELTRFFLREIRHGIEDTGIRAGIIKVATTGKATPFQEL
VLRAAARASLATGVPVTTHTSGSQRDGEQQAAIFESEGLSPSRVCIGHSD
DTDDLRYLTGLAARGYLVGLDRMPYSAIGLRGNASALALFGTRSWQTRAL
LIKALIDRGYKDRILVSHDWLFGFSSYVTNIMRVMDRINPDGMAFVPLRV
IPFLREKGVPPETLAGVTVANPARFLSPT
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 chain5w7h Chain B Residue 401 [Download ligand structure] [Download structure with residue number starting from 1] [View ligand structure]
Receptor-Ligand Complex Structure
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PDB5w7h Hydrogel-Immobilized Supercharged Proteins
Resolution2.75 Å
Binding residue
(original residue number in PDB)		H55 H57 K169 D301
Binding residue
(residue number reindexed from 1)		H23 H25 K137 D269
Annotation score4
Enzymatic activity
Catalytic site (original residue number in PDB) H55 H57 K169 H201 H230 D233 R254 D301
Catalytic site (residue number reindexed from 1) H23 H25 K137 H169 H198 D201 R222 D269
Enzyme Commision number ?
Gene Ontology
Molecular Function
GO:0008270 zinc ion binding
GO:0016788 hydrolase activity, acting on ester bonds
Biological Process
GO:0009056 catabolic process

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Molecular Function
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Biological Process
External links
PDB RCSB:5w7h, PDBe:5w7h, PDBj:5w7h
PDBsum5w7h
PubMed
UniProtQ93LD7

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