Structure of PDB 2q04 Chain F Binding Site BS01

Receptor Information
>2q04 Chain F (length=204) Species: 262543 (Exiguobacterium sibiricum 255-15) [Search protein sequence] [Download receptor structure] [Download structure with residue number starting from 1] [View receptor structure]
QFNHRTLETSLGPVEIEGPVTSQILATYKLDPGLTAFRQPAEQHEALVEI
AALEEGRIIIARQGNDIIGYVTFLYPDPYETWSEGNNPYILELGAIEVAA
RFRGQQIGKKLLEVSMLDPAMEHYLILTTEYYWHWDLKGSGLSVWDYRKI
MEKMMNHGGLVFFPTDDPEIASHPANCLMARIGKHVAPEVVAHFDALRLR
RRFM
Ligand information
Ligand IDCA
InChIInChI=1S/Ca/q+2
InChIKeyBHPQYMZQTOCNFJ-UHFFFAOYSA-N
SMILES
SoftwareSMILES
CACTVS 3.341[Ca++]
ACDLabs 10.04
OpenEye OEToolkits 1.5.0		[Ca+2]
FormulaCa
NameCALCIUM ION
ChEMBL
DrugBankDB14577
ZINC
PDB chain2q04 Chain F Residue 211 [Download ligand structure] [Download structure with residue number starting from 1] [View ligand structure]
Receptor-Ligand Complex Structure
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PDB2q04 Crystal structure of acetoin utilization protein (ZP_00540088.1) from Exiguobacterium sibiricum 255-15 at 2.33 A resolution
Resolution2.33 Å
Binding residue
(original residue number in PDB)		G98 T133
Binding residue
(residue number reindexed from 1)		G94 T129
Annotation score4
Enzymatic activity
Enzyme Commision number ?
Gene Ontology
Molecular Function
GO:0016747 acyltransferase activity, transferring groups other than amino-acyl groups
GO:0019152 acetoin dehydrogenase (NAD+) activity
GO:0046872 metal ion binding
Biological Process
GO:0045150 acetoin catabolic process

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Molecular Function
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Biological Process
External links
PDB RCSB:2q04, PDBe:2q04, PDBj:2q04
PDBsum2q04
PubMed
UniProtB1YKD7

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