Structure of PDB 7qz2 Chain A Binding Site BS01

Receptor Information
>7qz2 Chain A (length=129) Species: 287 (Pseudomonas aeruginosa) [Search protein sequence] [Download receptor structure] [Download structure with residue number starting from 1] [View receptor structure]
GRPPRLLCVDDNPANLLLVQTLLSDLGAQVTAVDSGYAALEVVQRERFDL
VFMDVQMPGMDGRQATEAIRRWEAEREVSPVPVIALTAHALSNEKRALLQ
AGMDDYLTKPIDEQQLAQVVLKWTGLSLG
Ligand information
Ligand IDBEF
InChIInChI=1S/Be.3FH/h;3*1H/q+2;;;/p-3
InChIKeyOGIAHMCCNXDTIE-UHFFFAOYSA-K
SMILES
SoftwareSMILES
OpenEye OEToolkits 1.5.0[Be-](F)(F)F
ACDLabs 10.04
CACTVS 3.341		F[Be-](F)F
FormulaBe F3
NameBERYLLIUM TRIFLUORIDE ION
ChEMBL
DrugBank
ZINC
PDB chain7qz2 Chain A Residue 804 [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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PDB7qz2 Insights into the atypical autokinase activity of the Pseudomonas aeruginosa GacS histidine kinase and its interaction with RetS.
Resolution1.87 Å
Binding residue
(original residue number in PDB)		D715 V716 Q717 T748 K770
Binding residue
(residue number reindexed from 1)		D54 V55 Q56 T87 K109
Annotation score1
Enzymatic activity
Enzyme Commision number 2.7.13.3: histidine kinase.
Gene Ontology
Biological Process
GO:0000160 phosphorelay signal transduction system

View graph for
Biological Process
External links
PDB RCSB:7qz2, PDBe:7qz2, PDBj:7qz2
PDBsum7qz2
PubMed35767996
UniProtG3XD98

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