Structure of PDB 5m3k Chain E Binding Site BS01

Receptor Information
>5m3k Chain E (length=145) Species: 220664 (Pseudomonas protegens Pf-5) [Search protein sequence] [Download receptor structure] [Download structure with residue number starting from 1] [View receptor structure]
SMYPEQIHRMTTASMLREWREHGGKYRLEGSQCEECNEIFFPRRTVCGAC
NSLSVKPYRCARSGKIEVMAPAENPILAAMGYGETVPRIMAMVRLDDGLV
IASEIVDVCDQQQLKVGAPVRMVIRKHVRESNLAWQYAYKFVLDI
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 chain5m3k Chain E Residue 200 [Download ligand structure] [Download structure with residue number starting from 1] [View ligand structure]
Receptor-Ligand Complex Structure
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PDB5m3k Structure and Catalytic Mechanism of a Bacterial Friedel-Crafts Acylase.
Resolution2.83 Å
Binding residue
(original residue number in PDB)
C34 C37 C48 C51
Binding residue
(residue number reindexed from 1)
C33 C36 C47 C50
Annotation score4
Enzymatic activity
Enzyme Commision number ?
Gene Ontology
Molecular Function
GO:0046872 metal ion binding

View graph for
Molecular Function
External links
PDB RCSB:5m3k, PDBe:5m3k, PDBj:5m3k
PDBsum5m3k
PubMed30318713
UniProtQ4K419

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