Structure of PDB 2oaa Chain B Binding Site BS03

Receptor Information
>2oaa Chain B (length=248) Species: 1272 (Kocuria varians) [Search protein sequence] [Download receptor structure] [Download structure with residue number starting from 1] [View receptor structure]
KSMSEYLNLLKEAIQNVVDGGWHETKRKGNTGIGKTFEDLLEKEEDNLDA
PDFHDIEIKTHETAAKSLLTLFTKSPTNPRGANTMLRNRYGKKDEYGNNI
LHQTVSGNRKTNSNSYNYDFKIDIDWESQVVRLEVFDKQDIMIDNSVYWS
FDSLQNQLDKKLKYIAVISAESKIENEKKYYKYNSANLFTDLTVQSLCRG
IENGDIKVDIRIGAYHSGKKKGKTHDHGTAFRINMEKLLEYGEVKVIV
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 chain2oaa Chain B Residue 602 [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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PDB2oaa Restriction endonuclease MvaI is a monomer that recognizes its target sequence asymmetrically.
Resolution1.5 Å
Binding residue
(original residue number in PDB)		D50 E55 I56
Binding residue
(residue number reindexed from 1)		D52 E57 I58
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:2oaa, PDBe:2oaa, PDBj:2oaa
PDBsum2oaa
PubMed17344322
UniProtQ8RNV5

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