Structure of PDB 3bs1 Chain A Binding Site BS03

Receptor Information
>3bs1 Chain A (length=103) Species: 1280 (Staphylococcus aureus) [Search protein sequence] [Download receptor structure] [Download structure with residue number starting from 1] [View receptor structure]
MDNSVETIELKRGSNSVYVQYDDIMFFESSTKSHRLIAHLDNRQIEFYGN
LKELSQLDDRFFRCHNSFVVNRHNIESIDSKERIVYFKNKEHCYASVRNV
KKI
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 chain3bs1 Chain A Residue 2 [Download ligand structure] [Download structure with residue number starting from 1] [View ligand structure]
Receptor-Ligand Complex Structure
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PDB3bs1 Structure of the Staphylococcus aureus AgrA LytTR Domain Bound to DNA Reveals a Beta Fold with an Unusual Mode of Binding.
Resolution1.6 Å
Binding residue
(original residue number in PDB)		S190 D193 F196
Binding residue
(residue number reindexed from 1)		S55 D58 F61
Annotation score4
Enzymatic activity
Enzyme Commision number ?
Gene Ontology
Molecular Function
GO:0000156 phosphorelay response regulator activity
GO:0003677 DNA binding

View graph for
Molecular Function
External links
PDB RCSB:3bs1, PDBe:3bs1, PDBj:3bs1
PDBsum3bs1
PubMed18462677
UniProtP0A0I7|AGRA_STAAU Accessory gene regulator protein A (Gene Name=agrA)

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