Structure of PDB 2o1k Chain B Binding Site BS01

Receptor Information
>2o1k Chain B (length=43) Species: 10923 (Simian rotavirus A/SA11) [Search protein sequence] [Download receptor structure] [Download structure with residue number starting from 1] [View receptor structure]
IEKQMDRVVKEMRRQLEMIDKLTTREIEQVELLKRIYDKLTVQ
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 chain2o1k Chain B Residue 501 [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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PDB2o1k Structure of the extended diarrhea-inducing domain of rotavirus enterotoxigenic protein
Resolution1.67 Å
Binding residue
(original residue number in PDB)
E120 Q123
Binding residue
(residue number reindexed from 1)
E26 Q29
Annotation score4
Enzymatic activity
Enzyme Commision number ?
External links
PDB RCSB:2o1k, PDBe:2o1k, PDBj:2o1k
PDBsum2o1k
PubMed
UniProtP04512|NSP4_ROTS1 Non-structural glycoprotein 4

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