Structure of PDB 7vej Chain A Binding Site BS03

Receptor Information
>7vej Chain A (length=443) Species: 3527 (Phytolacca americana) [Search protein sequence] [Download receptor structure] [Download structure with residue number starting from 1] [View receptor structure]
QLHVVFFPIMAHGHMIPTLDIARLFAARNVRATIITTPLNAHTFTKAITI
HLELFKFPAQDVGLPEGCENLEQALGSSLIEKFFKGVGLLREQLEAYLEK
TRPNCLVADMFFPWATDSAAKFNIPRLVFHGTSFFSLCALEVVRLYEPHK
NVSSDEELFSLPLFPHDIKMMRLQLPEDVWKHEKAEGKTRLKLIKESELK
SYGVIVNSFYELEPNYAEFFRKELGRRAWNIGPVSLCNREHECLKWLNSK
KKNSVIYICFGSTAHQIAPQLYEIAMALEASGQEFIWVVDSWLPRGFEQR
VEGKGLIIRGWAPQVLILEHEAIGAFVTHCGWNSTLEGITAGVPMVTWPI
FAEQFYNEKLVNQILKIGVPVGANKWSRETSIEDVIKKDAIEKALREIMV
GDEAEERRSRAKKLKEMAWKAVEEGGSSYSDLSALIEELRGYH
Ligand information
Ligand IDKMP
InChIInChI=1S/C15H10O6/c16-8-3-1-7(2-4-8)15-14(20)13(19)12-10(18)5-9(17)6-11(12)21-15/h1-6,16-18,20H
InChIKeyIYRMWMYZSQPJKC-UHFFFAOYSA-N
SMILES
SoftwareSMILES
OpenEye OEToolkits 1.5.0c1cc(ccc1C2=C(C(=O)c3c(cc(cc3O2)O)O)O)O
CACTVS 3.341Oc1ccc(cc1)C2=C(O)C(=O)c3c(O)cc(O)cc3O2
ACDLabs 10.04O=C1c3c(OC(=C1O)c2ccc(O)cc2)cc(O)cc3O
FormulaC15 H10 O6
Name3,5,7-TRIHYDROXY-2-(4-HYDROXYPHENYL)-4H-CHROMEN-4-ONE;
KAEMPHEROL
ChEMBLCHEMBL150
DrugBankDB01852
ZINCZINC000003869768
PDB chain7vej Chain A Residue 605 [Download ligand structure] [Download structure with residue number starting from 1] [View ligand structure]
Receptor-Ligand Complex Structure
Global viewLocal viewStructure summary

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PDB7vej Structural basis for substrate recognition in the Phytolacca americana glycosyltransferase PaGT3.
Resolution1.85 Å
Binding residue
(original residue number in PDB)		H20 M125 T147
Binding residue
(residue number reindexed from 1)		H14 M110 T132
Annotation score1
Enzymatic activity
Enzyme Commision number 2.4.1.-
Gene Ontology
Molecular Function
GO:0008194 UDP-glycosyltransferase activity
GO:0016757 glycosyltransferase activity
GO:0035251 UDP-glucosyltransferase activity
GO:0046527 glucosyltransferase activity

View graph for
Molecular Function
External links
PDB RCSB:7vej, PDBe:7vej, PDBj:7vej
PDBsum7vej
PubMed35234151
UniProtB5MGN9

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