Structure of PDB 4bt4 Chain A Binding Site BS01

Receptor Information
>4bt4 Chain A (length=236) Species: 1393 (Brevibacillus brevis) [Search protein sequence] [Download receptor structure] [Download structure with residue number starting from 1] [View receptor structure]
APKNVLFQYSTINALMLGQFEGDLTLKDLKLRGDMGLGTINDLDGEMIQM
GTKFYQIDSTGKLSELPESVKTPFAVTTHFEPKEKTTLTNVQDYNQLTKM
LEEKFENKNVFYAVKLTGTFKMVKARTVPKQTRPYPQLTEVTKKQSEFEF
KNVKGTLIGFYTPNYAAALNVPGFHLHFITEDKTSGGHVLNLQFDNANLE
ISPIHEFDVQLPHTDDFAHSDLTQVTTSQVHQAESE
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 chain4bt4 Chain A Residue 301 [Download ligand structure] [Download structure with residue number starting from 1] [View ligand structure]
Receptor-Ligand Complex Structure
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PDB4bt4 Structure and Mechanism of Acetolactate Decarboxylase.
Resolution1.6 Å
Binding residue
(original residue number in PDB)		H194 H196 H207
Binding residue
(residue number reindexed from 1)		H175 H177 H188
Annotation score1
Enzymatic activity
Enzyme Commision number 4.1.1.5: acetolactate decarboxylase.
Gene Ontology
Molecular Function
GO:0016831 carboxy-lyase activity
GO:0047605 acetolactate decarboxylase activity
Biological Process
GO:0045151 acetoin biosynthetic process

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Molecular Function
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Biological Process
External links
PDB RCSB:4bt4, PDBe:4bt4, PDBj:4bt4
PDBsum4bt4
PubMed23985082
UniProtP23616|ALDC_BREBE Alpha-acetolactate decarboxylase (Gene Name=aldB)

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