Structure of PDB 4qht Chain B Binding Site BS02

Receptor Information
>4qht Chain B (length=245) Species: 345073 (Vibrio cholerae O395) [Search protein sequence] [Download receptor structure] [Download structure with residue number starting from 1] [View receptor structure]
HMVVADTKSLKLLALADKVAKTDANVMILGPSGSGKEVMSRYIHNASPRK
EGPFIAINCAAIPDNMLEATLFGYEKGAFTGAVQACPGKFEQAQGGTILL
DEISEMDLNLQAKLLRVLQEREVERLGSRKSIKLDVRVLATSNRDLKQYV
QAGHFREDLYYRLNVFPLTWPALCERKDDIEPLANHLIERHCKKLGLPVP
SIAPNAITKLLNYPWPGNVRELDNVVQRALILSENGHIQSEHILL
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 chain4qht Chain B Residue 402 [Download ligand structure] [Download structure with residue number starting from 1] [View ligand structure]
Receptor-Ligand Complex Structure
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PDB4qht Unique ATPase site architecture triggers cis-mediated synchronized ATP binding in heptameric AAA+-ATPase domain of flagellar regulatory protein FlrC
Resolution2.559 Å
Binding residue
(original residue number in PDB)		D230 E231
Binding residue
(residue number reindexed from 1)		D101 E102
Annotation score1
Enzymatic activity
Enzyme Commision number ?
Gene Ontology
Molecular Function
GO:0005524 ATP binding
GO:0008134 transcription factor binding
GO:0016887 ATP hydrolysis 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:4qht, PDBe:4qht, PDBj:4qht
PDBsum4qht
PubMed25688103
UniProtA0A0H3AHP1

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