Structure of PDB 6qlg Chain C Binding Site BS05

Receptor Information
>6qlg Chain C (length=187) Species: 5061 (Aspergillus niger) [Search protein sequence] [Download receptor structure] [Download structure with residue number starting from 1] [View receptor structure]
RRRRIVVAMTGATGAMLGIKVLIALRRLNVETHLVMSKWAEATIKYETDY
HPSNVRALADYVHNINDMAAPVSSGSFRADGMIVVPCSMKTLAAIHSGFC
DDLISRTADVMLKERRRLVLVARETPLSEIHLRNMLEVTRAGAVIFPPVP
AFYIKAGSIEDLIDQSVGRMLDLFDLDTGDFERWNGW
Ligand information
Ligand IDPO4
InChIInChI=1S/H3O4P/c1-5(2,3)4/h(H3,1,2,3,4)/p-3
InChIKeyNBIIXXVUZAFLBC-UHFFFAOYSA-K
SMILES
SoftwareSMILES
CACTVS 3.341[O-][P]([O-])([O-])=O
ACDLabs 10.04[O-]P([O-])([O-])=O
OpenEye OEToolkits 1.5.0[O-]P(=O)([O-])[O-]
FormulaO4 P
NamePHOSPHATE ION
ChEMBL
DrugBankDB14523
ZINC
PDB chain6qlg Chain C Residue 305 [Download ligand structure] [Download structure with residue number starting from 1] [View ligand structure]
Receptor-Ligand Complex Structure
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PDB6qlg The UbiX flavin prenyltransferase reaction mechanism resembles class I terpene cyclase chemistry.
Resolution2.15 Å
Binding residue
(original residue number in PDB)		K83 H89
Binding residue
(residue number reindexed from 1)		K45 H51
Annotation score1
Enzymatic activity
Enzyme Commision number 2.5.1.129: flavin prenyltransferase.
Gene Ontology
Molecular Function
GO:0000166 nucleotide binding
GO:0003824 catalytic activity
GO:0004659 prenyltransferase activity
GO:0016831 carboxy-lyase activity
GO:0106141 flavin prenyltransferase activity
Cellular Component
GO:0005739 mitochondrion

View graph for
Molecular Function
View graph for
Cellular Component
External links
PDB RCSB:6qlg, PDBe:6qlg, PDBj:6qlg
PDBsum6qlg
PubMed31142738
UniProtA3F715

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