Structure of PDB 7ae4 Chain F Binding Site BS01

Receptor Information
>7ae4 Chain F (length=476) Species: 29345 (Sedimentibacter hydroxybenzoicus) [Search protein sequence] [Download receptor structure] [Download structure with residue number starting from 1] [View receptor structure]
AKVYKDLREFLEVLEQEGQLIRVKEEVNPEPDIAAAGRAAANLGKNQPAV
FFEKIKGYKYSVVTNVHGSWQNHALMLGLDKNTSTKDQFYELNRRWDKFP
VPPNVVKREAAPCKENVIDKDINLFEILPLYRINEQDGGFYISKASVVTA
DPEYPDDFNKLNVGTYRIQVKDRDRVGIQALAMHDIAVQLEKAEAENKPL
PIAITIGNNPLVTFMASTPVGYNQNEYEFVGALQDGVPMDIVKSDLYDHL
YVPAGSEVVLEGHIIPRVRTVEGPFGEFPGSYSGARLQCEVKIDRITHRT
NPIFENLYLGIPWTEIDYLMALNTSVPLYKQLKETMPEVVAVNAMYTHGI
GVIISTKVRYGGYAKGVAFRLLSTPHGMPYSKIVIVVDEFVDPFNLEQVM
WALTTRVHPGKDVSIIENCPGMPLDPSTNPPGMHTKMIIDATTPVPPEPN
PRETQLLDPPDGTEEWEEKLKELLKN
Ligand information
Ligand IDMG
InChIInChI=1S/Mg/q+2
InChIKeyJLVVSXFLKOJNIY-UHFFFAOYSA-N
SMILES
SoftwareSMILES
ACDLabs 10.04
OpenEye OEToolkits 1.5.0		[Mg+2]
CACTVS 3.341[Mg++]
FormulaMg
NameMAGNESIUM ION
ChEMBL
DrugBankDB01378
ZINC
PDB chain7ae4 Chain F Residue 505 [Download ligand structure] [Download structure with residue number starting from 1] [View ligand structure]
Receptor-Ligand Complex Structure
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PDB7ae4 Domain mobility and allosteric activation of UbiD decarboxylases
Resolution3.31 Å
Binding residue
(original residue number in PDB)		N163 D186 E227
Binding residue
(residue number reindexed from 1)		N162 D185 E226
Annotation score1
Enzymatic activity
Enzyme Commision number 4.1.1.61: 4-hydroxybenzoate decarboxylase.
4.1.1.63: protocatechuate decarboxylase.
Gene Ontology
Molecular Function
GO:0008694 3-octaprenyl-4-hydroxybenzoate carboxy-lyase activity
GO:0016831 carboxy-lyase activity
GO:0018799 4-hydroxybenzoate decarboxylase activity
GO:0046872 metal ion binding
GO:0050223 protocatechuate decarboxylase activity
Biological Process
GO:0006744 ubiquinone biosynthetic process
GO:0009056 catabolic process
GO:0009636 response to toxic substance
Cellular Component
GO:0005737 cytoplasm
GO:0005829 cytosol

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Molecular Function
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Biological Process
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Cellular Component
External links
PDB RCSB:7ae4, PDBe:7ae4, PDBj:7ae4
PDBsum7ae4
PubMed
UniProtQ9S4M7|YCLC_SEDHY Phenolic acid decarboxylase (Gene Name=shdC)

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