Structure of PDB 8sft Chain C Binding Site BS01
Receptor Information
>8sft Chain C (length=427) Species:
32264
(Tetranychus urticae) [
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KSLKILFTALFGPGHLNACLGIGSLLRKRGHQIYFAHFPRHRATIEKHGF
LFISLLDYAEPEFPIVDMLPDIGIIAKFAFERMHKLTPLELFRHASGKHT
FAGMVNGSKGENYAMMKIVKEYKPDVCLADYLFNMPWMFTVDCPVIPVKS
VNPIELYNGPPALTGCSIHDPPSVREEIEQLARKSELELESELEKLFAHF
NVPLVSYNYAQQLGIYIYPGPLDYKELGSPKENWVRLDSSIRSTEISNFE
LPEKLKDKPGKLIYVSMGSLASAVTELLTMILTPLANSPHRFIVSTGPNG
DSIKLYDNMWGDKFINQVALLPKVDLFITHGGSNSLIEGLTAGKPLIAIP
QFGDQLDNAQRIADLGLGVRLNLHEFSGEKLLKAIEDVLNDEKINANVAR
VSEELKKSDSKDKVISLIEKLARDKKL
Ligand information
Ligand ID
KMP
InChI
InChI=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
InChIKey
IYRMWMYZSQPJKC-UHFFFAOYSA-N
SMILES
Software
SMILES
OpenEye OEToolkits 1.5.0
c1cc(ccc1C2=C(C(=O)c3c(cc(cc3O2)O)O)O)O
CACTVS 3.341
Oc1ccc(cc1)C2=C(O)C(=O)c3c(O)cc(O)cc3O2
ACDLabs 10.04
O=C1c3c(OC(=C1O)c2ccc(O)cc2)cc(O)cc3O
Formula
C15 H10 O6
Name
3,5,7-TRIHYDROXY-2-(4-HYDROXYPHENYL)-4H-CHROMEN-4-ONE;
KAEMPHEROL
ChEMBL
CHEMBL150
DrugBank
DB01852
ZINC
ZINC000003869768
PDB chain
8sft Chain C Residue 501 [
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Receptor-Ligand Complex Structure
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PDB
8sft
Crystal structure of TuUGT202A2 (Tetur22g00270) in complex with kaempferol
Resolution
2.75 Å
Binding residue
(original residue number in PDB)
M78 T110 F111 M114 L142
Binding residue
(residue number reindexed from 1)
M68 T100 F101 M104 L132
Annotation score
1
Enzymatic activity
Enzyme Commision number
?
Gene Ontology
Molecular Function
GO:0000166
nucleotide binding
GO:0008194
UDP-glycosyltransferase activity
GO:0016757
glycosyltransferase activity
Cellular Component
GO:0016020
membrane
View graph for
Molecular Function
View graph for
Cellular Component
External links
PDB
RCSB:8sft
,
PDBe:8sft
,
PDBj:8sft
PDBsum
8sft
PubMed
UniProt
T1KUK4
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