Structure of PDB 6gic Chain B Binding Site BS03

Receptor Information
>6gic Chain B (length=237) Species: 5325 (Trametes versicolor) [Search protein sequence] [Download receptor structure] [Download structure with residue number starting from 1] [View receptor structure]
CTEQITLYTTTFSPYGHRAHIALEEAGAEYTLCQINVHRDKPEWYKRVNP
LGKVPAITFGGPQVPPDEPSPESEKLVESLALLEFVADVFPEAKLLPASP
VQRARARAFIAIYQNYLHDQFRDAFFRGEPVGPFLQALETLQSALPPAGF
AVGEWSLAEAAVAPFLARMMLYLDAGLGKYSEADGETMRAALASERFARI
SQYVRDIRARASFVKSWGGDDVQLEAAKAIPMLRRPA
Ligand information
Ligand IDEZH
InChIInChI=1S/C14H12O4/c15-11-4-3-10(14(18)8-11)2-1-9-5-12(16)7-13(17)6-9/h1-8,15-18H/b2-1-
InChIKeyPDHAOJSHSJQANO-UPHRSURJSA-N
SMILES
SoftwareSMILES
OpenEye OEToolkits 2.0.6c1cc(c(cc1O)O)/C=C\c2cc(cc(c2)O)O
CACTVS 3.385Oc1ccc(\C=C/c2cc(O)cc(O)c2)c(O)c1
CACTVS 3.385Oc1ccc(C=Cc2cc(O)cc(O)c2)c(O)c1
OpenEye OEToolkits 2.0.6c1cc(c(cc1O)O)C=Cc2cc(cc(c2)O)O
FormulaC14 H12 O4
Namecis-oxyresveratrol
ChEMBL
DrugBank
ZINCZINC000005641949
PDB chain6gic Chain B Residue 303 [Download ligand structure] [Download structure with residue number starting from 1] [View ligand structure]
Receptor-Ligand Complex Structure
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PDB6gic Fungal glutathione transferases as tools to explore the chemical diversity of Amazonian wood extractives
Resolution2.304 Å
Binding residue
(original residue number in PDB)		L82 E86 A113 Q116 N117
Binding residue
(residue number reindexed from 1)		L80 E84 A111 Q114 N115
Annotation score1
Enzymatic activity
Enzyme Commision number ?
Gene Ontology
Molecular Function
GO:0046872 metal ion binding
Cellular Component
GO:0005737 cytoplasm

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Molecular Function
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Cellular Component
External links
PDB RCSB:6gic, PDBe:6gic, PDBj:6gic
PDBsum6gic
PubMed
UniProtA0A452CSY5

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