Structure of PDB 1p0z Chain A Binding Site BS03

Receptor Information
>1p0z Chain A (length=131) Species: 573 (Klebsiella pneumoniae) [Search protein sequence] [Download receptor structure] [Download structure with residue number starting from 1] [View receptor structure]
EERLHYQVGQRALIQAMQISAMPELVEAVQKRDLARIKALIDPMRSFSDA
TYITVGDASGQRLYHVNPDEIGKSMEGGDSDEALINAKSYVSVRKGSLGS
SLRGKSPIQDATGKVIGIVSVGYTIEQLEHH
Ligand information
Ligand IDOMO
InChIInChI=1S/Mo.2H2O.O/h;2*1H2;/q+8;;;/p-2
InChIKeyGKDPEXRCAVYDOG-UHFFFAOYSA-L
SMILES
SoftwareSMILES
OpenEye OEToolkits 1.7.2O[Mo+6](=O)O
CACTVS 3.370O[Mo+6](O)=O
ACDLabs 12.01O=[Mo+6](O)O
FormulaH2 Mo O3
NameMO(VI)(=O)(OH)2 CLUSTER
ChEMBL
DrugBankDB04494
ZINC
PDB chain1p0z Chain A Residue 1631 [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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PDB1p0z The structure of the periplasmic ligand-binding domain of the sensor kinase CitA reveals the first extracellular PAS domain.
Resolution1.6 Å
Binding residue
(original residue number in PDB)		M79 G81 R98 R107
Binding residue
(residue number reindexed from 1)		M75 G77 R94 R103
Annotation score4
Enzymatic activity
Enzyme Commision number 2.7.13.3: histidine kinase.
External links
PDB RCSB:1p0z, PDBe:1p0z, PDBj:1p0z
PDBsum1p0z
PubMed12867417
UniProtP52687|CITA_KLEPN Sensor histidine kinase CitA (Gene Name=citA)

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