Structure of PDB 2i34 Chain A Binding Site BS02

Receptor Information
>2i34 Chain A (length=237) Species: 1392 (Bacillus anthracis) [Search protein sequence] [Download receptor structure] [Download structure with residue number starting from 1] [View receptor structure]
VKLTDQQLMADLWYQTAGEMKALYYQGYNTGQLKLDAALAKGTEKKPAIV
LDLDETVLDNSPHQAMSVKTGKGYPYKWDDWINKAEAEALPGSIDFLKYT
ESKGVDIYYISNRKTNQLDATIKNLERVGAPQATKEHILLQDPKEKGKEK
RRELVSQTHDIVLFFGDNLSDFTGFDGKSVKDRNQAVTDSKAQFGEKFII
FPNPMYGDWEGALYDYNFKKSDAEKDKIRHDNLKSFD
Ligand information
Ligand IDWO4
InChIInChI=1S/4O.W/q;;2*-1;
InChIKeyPBYZMCDFOULPGH-UHFFFAOYSA-N
SMILES
SoftwareSMILES
OpenEye OEToolkits 1.5.0[O-][W](=O)(=O)[O-]
ACDLabs 10.04
CACTVS 3.341		[O-][W]([O-])(=O)=O
FormulaO4 W
NameTUNGSTATE(VI)ION
ChEMBL
DrugBank
ZINC
PDB chain2i34 Chain A Residue 401 [Download ligand structure] [Download structure with residue number starting from 1] [View ligand structure]
Receptor-Ligand Complex Structure
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PDB2i34 The crystal structure of the class C acid phosphatase from Bacillus anthracis
Resolution2.0 Å
Binding residue
(original residue number in PDB)		D65 L66 D67 S124 N125 K161
Binding residue
(residue number reindexed from 1)		D52 L53 D54 S111 N112 K148
Annotation score1
Enzymatic activity
Enzyme Commision number 3.1.3.2: acid phosphatase.
Gene Ontology
Cellular Component
GO:0009279 cell outer membrane

View graph for
Cellular Component
External links
PDB RCSB:2i34, PDBe:2i34, PDBj:2i34
PDBsum2i34
PubMed
UniProtA0A6L7HE29

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