Structure of PDB 6is3 Chain C Binding Site BS01

Receptor Information
>6is3 Chain C (length=121) Species: 273036 (Staphylococcus aureus RF122) [Search protein sequence] [Download receptor structure] [Download structure with residue number starting from 1] [View receptor structure]
HHHTQILIVEDEQNLARFLELELTHENYNVDTEYDGQDGLDKALSHYYDL
IILDLMLPSINGLEICRKIRQQQSTPIIIITAKSDTYDKVAGLDYGADDY
IVKPFDIEELLARIRAILRRQ
Ligand information
Ligand IDCA
InChIInChI=1S/Ca/q+2
InChIKeyBHPQYMZQTOCNFJ-UHFFFAOYSA-N
SMILES
SoftwareSMILES
CACTVS 3.341[Ca++]
ACDLabs 10.04
OpenEye OEToolkits 1.5.0
[Ca+2]
FormulaCa
NameCALCIUM ION
ChEMBL
DrugBankDB14577
ZINC
PDB chain6is3 Chain C Residue 202 [Download ligand structure] [Download structure with residue number starting from 1] [View ligand structure]
Receptor-Ligand Complex Structure
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PDB6is3 Deciphering the activation and recognition mechanisms of Staphylococcus aureus response regulator ArlR.
Resolution1.549 Å
Binding residue
(original residue number in PDB)
D9 D52 M54
Binding residue
(residue number reindexed from 1)
D11 D54 M56
Annotation score4
Enzymatic activity
Enzyme Commision number ?
Gene Ontology
Biological Process
GO:0000160 phosphorelay signal transduction system

View graph for
Biological Process
External links
PDB RCSB:6is3, PDBe:6is3, PDBj:6is3
PDBsum6is3
PubMed31598698
UniProtQ2YY03|ARLR_STAAB Response regulator ArlR (Gene Name=arlR)

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