Structure of PDB 5xne Chain B Binding Site BS01

Receptor Information
>5xne Chain B (length=234) Species: 224308 (Bacillus subtilis subsp. subtilis str. 168) [Search protein sequence] [Download receptor structure] [Download structure with residue number starting from 1] [View receptor structure]
SQIYQVSTMTSLLDGVYDGDFELSEIPKYGDFGIGTFNKLDGELIGFDGE
FYRLRSDGTATPVQNGDRSPFCSFTFFTPDMTHKIDAKMTREDFEKEINS
MLPSRNLFYAIRIDGLFKKVQTRTVELQEKPYVPMVEAVKTQPIFNFDNV
RGTIVGFLTPAYANGIAVSGYHLHFIDEGRNSGGHVFDYVLEDCTVTISQ
KMNMNLRLPNTADFFNANLDNPDFAKDIETTEGS
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 chain5xne Chain B Residue 301 [Download ligand structure] [Download structure with residue number starting from 1] [View ligand structure]
Receptor-Ligand Complex Structure
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PDB5xne Structural and enzymatic characterization of acetolactate decarboxylase from Bacillus subtilis
Resolution1.501 Å
Binding residue
(original residue number in PDB)		H191 H193 H204
Binding residue
(residue number reindexed from 1)		H172 H174 H185
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:5xne, PDBe:5xne, PDBj:5xne
PDBsum5xne
PubMed29796971
UniProtQ04777|ALDC_BACSU Alpha-acetolactate decarboxylase (Gene Name=alsD)

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