Structure of PDB 4v33 Chain B Binding Site BS01

Receptor Information
>4v33 Chain B (length=316) Species: 1392 (Bacillus anthracis) [Search protein sequence] [Download receptor structure] [Download structure with residue number starting from 1] [View receptor structure]
EQGKISYNPITHESTNTTIHMTDIKDTLTEVQYKIWRTADGKETAKSLSS
KEKEKQFSLPFDTKEFEGKRGEFQIEAIGIKEDGKTIPLTKSAITFEQKV
PVLMYHAIDDYHGQGIKDLFVSPANFEAQMKYLKDNGYTLLTFERWGDIN
KVNKPIFVTFDDGMKNNMNAFHVLQKLKDDTFKPVATEYMIVNNVDAEGS
LSTSDIKEMVDSGIFSMQSHTATHADLPKITNYEEELKESKEKLEKITGK
PVIAVAYPFGHVDDKVVAETKKYYQFATTTKPGKFITKGEPDELLKMKRV
RIHHTTTVEQFASSIK
Ligand information
Ligand IDZN
InChIInChI=1S/Zn/q+2
InChIKeyPTFCDOFLOPIGGS-UHFFFAOYSA-N
SMILES
SoftwareSMILES
CACTVS 3.341[Zn++]
ACDLabs 10.04
OpenEye OEToolkits 1.5.0		[Zn+2]
FormulaZn
NameZINC ION
ChEMBLCHEMBL1236970
DrugBankDB14532
ZINC
PDB chain4v33 Chain B Residue 1362 [Download ligand structure] [Download structure with residue number starting from 1] [View ligand structure]
Receptor-Ligand Complex Structure
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PDB4v33 Two Putative Polysaccharide Deacetylases are Required for Osmotic Stability and Cell Shape Maintenance in Bacillus Anthracis.
Resolution1.48 Å
Binding residue
(original residue number in PDB)		D206 H264 H268
Binding residue
(residue number reindexed from 1)		D162 H220 H224
Annotation score4
Enzymatic activity
Enzyme Commision number ?
Gene Ontology
Molecular Function
GO:0003674 molecular_function
GO:0016810 hydrolase activity, acting on carbon-nitrogen (but not peptide) bonds
GO:0046872 metal ion binding
Biological Process
GO:0005975 carbohydrate metabolic process
GO:0008150 biological_process

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Molecular Function
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Biological Process
External links
PDB RCSB:4v33, PDBe:4v33, PDBj:4v33
PDBsum4v33
PubMed25825488
UniProtA0A6L8P8I1

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