Structure of PDB 3feu Chain A Binding Site BS01

Receptor Information
>3feu Chain A (length=183) Species: 312309 (Aliivibrio fischeri ES114) [Search protein sequence] [Download receptor structure] [Download structure with residue number starting from 1] [View receptor structure]
ADPKEGVQYEVLSTSLENDGMAPVTEVFALSCGHCRNMENFLPVISQEAG
TDIGKMHITFNQSAHIASMFYYAAEMQVDGAPDHAFMEDLFAATQMGEGT
TLTEQQEAYSKAFTSRGLVSPYDFNEEQRDTLIKKVDNAKMLSEKSGISS
VPTFVVNGKYNVLIGGHDDPKQIADTIRYLLEK
Ligand information
Ligand IDMG
InChIInChI=1S/Mg/q+2
InChIKeyJLVVSXFLKOJNIY-UHFFFAOYSA-N
SMILES
SoftwareSMILES
ACDLabs 10.04
OpenEye OEToolkits 1.5.0		[Mg+2]
CACTVS 3.341[Mg++]
FormulaMg
NameMAGNESIUM ION
ChEMBL
DrugBankDB01378
ZINC
PDB chain3feu Chain A Residue 183 [Download ligand structure] [Download structure with residue number starting from 1] [View ligand structure]
Receptor-Ligand Complex Structure
Global viewLocal viewStructure summary

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PDB3feu Crystal Structure of DsbA-like thioredoxin domain VF_A0457 from Vibrio fischeri
Resolution1.758 Å
Binding residue
(original residue number in PDB)		E74 V77 G79
Binding residue
(residue number reindexed from 1)		E75 V78 G80
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:3feu, PDBe:3feu, PDBj:3feu
PDBsum3feu
PubMed
UniProtQ5E0B9

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