Structure of PDB 3qy7 Chain A Binding Site BS03

Receptor Information
>3qy7 Chain A (length=247) Species: 1423 (Bacillus subtilis) [Search protein sequence] [Download receptor structure] [Download structure with residue number starting from 1] [View receptor structure]
MIDIHCHILPAMDDGAGDSADSIEMARAAVRQGIRTIIATPHHNNGVYKN
EPAAVREAADQLNKRLIKEDIPLHVLPGQEIRIYGEVEQDLAKRQLLSLN
DTKYILIEFPFDHVPRYAEQLFYDLQLKGYIPVIAHPERNREIRENPSLL
YHLVEKGAASQITSGSLAGIFGKQLKAFSLRLVEANLIHFVASDAHNVKT
RNFHTQEALYVLEKEFGSELPYMLTENAELLLRNQTIFRQPPQPVKR
Ligand information
Ligand IDMG
InChIInChI=1S/Mg/q+2
InChIKeyJLVVSXFLKOJNIY-UHFFFAOYSA-N
SMILES
SoftwareSMILES
ACDLabs 10.04
OpenEye OEToolkits 1.5.0		[Mg+2]
CACTVS 3.341[Mg++]
FormulaMg
NameMAGNESIUM ION
ChEMBL
DrugBankDB01378
ZINC
PDB chain3qy7 Chain A Residue 265 [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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PDB3qy7 Crystal structures of YwqE from Bacillus subtilis and CpsB from Streptococcus pneumoniae, unique metal-dependent tyrosine phosphatases.
Resolution1.62 Å
Binding residue
(original residue number in PDB)		D14 H42 H196
Binding residue
(residue number reindexed from 1)		D14 H42 H196
Annotation score1
Enzymatic activity
Enzyme Commision number 3.1.3.48: protein-tyrosine-phosphatase.
Gene Ontology
Molecular Function
GO:0004721 phosphoprotein phosphatase activity
GO:0004725 protein tyrosine phosphatase activity
GO:0030145 manganese ion binding

View graph for
Molecular Function
External links
PDB RCSB:3qy7, PDBe:3qy7, PDBj:3qy7
PDBsum3qy7
PubMed21605684
UniProtP96717|YWQE_BACSU Tyrosine-protein phosphatase YwqE (Gene Name=ywqE)

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