Structure of PDB 6aem Chain B Binding Site BS01

Receptor Information
>6aem Chain B (length=84) Species: 55601 (Vibrio anguillarum) [Search protein sequence] [Download receptor structure] [Download structure with residue number starting from 1] [View receptor structure]
ENQAPVANFELKTDGLSVSAFNYSHDEDGELVSYAWDFGNGQMSSEMAPS
WSYTRAGQYTVSLTVTDDKGATNTTTRTTQVEVP
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 chain6aem Chain B Residue 101 [Download ligand structure] [Download structure with residue number starting from 1] [View ligand structure]
Receptor-Ligand Complex Structure
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PDB6aem Structural basis for specific calcium binding by the polycystic-kidney-disease domain of Vibrio anguillarum protease Epp
Resolution1.272 Å
Binding residue
(original residue number in PDB)		N3 Q4 D27 D29 D68
Binding residue
(residue number reindexed from 1)		N2 Q3 D26 D28 D67
Annotation score4
Enzymatic activity
Enzyme Commision number ?
Gene Ontology
Molecular Function
GO:0046872 metal ion binding

View graph for
Molecular Function
External links
PDB RCSB:6aem, PDBe:6aem, PDBj:6aem
PDBsum6aem
PubMed30268503
UniProtA0A383R4X5

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