Structure of PDB 3hsr Chain B Binding Site BS01

Receptor Information
>3hsr Chain B (length=133) Species: 426430 (Staphylococcus aureus subsp. aureus str. Newman) [Search protein sequence] [Download receptor structure] [Download structure with residue number starting from 1] [View receptor structure]
GSHMYLSKQLCFLFYVSSKEIIKKYTNYLKEYDLTYTGYIVLMAIENDEK
LNIKKLGERVFLDSGTLTPLLKKLEKKDYVVRTRLQISLTEQGKAIKSPL
AEISVKVFNEFNISEREASDIINNLRNFVSKNF
Ligand information
Ligand IDBT6
InChIInChI=1S/C6H6S/c7-6-4-2-1-3-5-6/h1-5,7H
InChIKeyRMVRSNDYEFQCLF-UHFFFAOYSA-N
SMILES
SoftwareSMILES
ACDLabs 10.04
CACTVS 3.341		Sc1ccccc1
OpenEye OEToolkits 1.5.0c1ccc(cc1)S
FormulaC6 H6 S
Namebenzenethiol
ChEMBLCHEMBL119405
DrugBank
ZINCZINC000001867127
PDB chain3hsr Chain A Residue 1 [Download ligand structure] [Download structure with residue number starting from 1] [View ligand structure]
Receptor-Ligand Complex Structure
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PDB3hsr Crystal structures of the reduced, sulfenic acid, and mixed disulfide forms of SarZ, a redox active global regulator in Staphylococcus aureus.
Resolution1.9 Å
Binding residue
(original residue number in PDB)		K10 C13 F14
Binding residue
(residue number reindexed from 1)		K8 C11 F12
Annotation score1
Enzymatic activity
Enzyme Commision number ?
Gene Ontology
Molecular Function
GO:0003700 DNA-binding transcription factor activity
Biological Process
GO:0006355 regulation of DNA-templated transcription

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Molecular Function
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Biological Process
External links
PDB RCSB:3hsr, PDBe:3hsr, PDBj:3hsr
PDBsum3hsr
PubMed19586910
UniProtA0A0H3KA72

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