Structure of PDB 6sra Chain B Binding Site BS02

Receptor Information
>6sra Chain B (length=234) Species: 5325 (Trametes versicolor) [Search protein sequence] [Download receptor structure] [Download structure with residue number starting from 1] [View receptor structure]
PERITLYTAKICPFAQRVEIALHEAKAHHNVEQFQIDLQNKPEWYAPKVN
PASKVPAIAYGGPHVPPDQPSPESIKLAESLILVEFVADLFPHSHLLPHD
PVKRAQARFFIDGVSTKFIPAWHAFSQGKSSEEDFLTAVEHLQALLPESG
FAVGAYSIADVALTPFLGRARVTLKEDLGGYPRGEGPRVLAVLTSGTGRL
ARFGKYAQDLLARESFQATFDEAYITERYKARFA
Ligand information
Ligand IDCWE
InChIInChI=1S/C15H12O5/c16-9-3-1-8(2-4-9)13-7-12(19)15-11(18)5-10(17)6-14(15)20-13/h1-6,13,16-18H,7H2/t13-/m1/s1
InChIKeyFTVWIRXFELQLPI-CYBMUJFWSA-N
SMILES
SoftwareSMILES
CACTVS 3.385Oc1ccc(cc1)[C@H]2CC(=O)c3c(O)cc(O)cc3O2
OpenEye OEToolkits 2.0.6c1cc(ccc1[C@H]2CC(=O)c3c(cc(cc3O2)O)O)O
OpenEye OEToolkits 2.0.6c1cc(ccc1C2CC(=O)c3c(cc(cc3O2)O)O)O
CACTVS 3.385Oc1ccc(cc1)[CH]2CC(=O)c3c(O)cc(O)cc3O2
FormulaC15 H12 O5
NameR-naringenin
ChEMBL
DrugBank
ZINCZINC000000001785
PDB chain6sra Chain B Residue 302 [Download ligand structure] [Download structure with residue number starting from 1] [View ligand structure]
Receptor-Ligand Complex Structure
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PDB6sra Diversity of Omega Glutathione Transferases in mushroom-forming fungi revealed by phylogenetic, transcriptomic, biochemical and structural approaches.
Resolution2.206 Å
Binding residue
(original residue number in PDB)		L82 E86 R109 D113 S116
Binding residue
(residue number reindexed from 1)		L81 E85 R108 D112 S115
Annotation score1
Enzymatic activity
Enzyme Commision number ?
Gene Ontology

View graph for
Cellular Component
External links
PDB RCSB:6sra, PDBe:6sra, PDBj:6sra
PDBsum6sra
PubMed33450403
UniProtR7S7J5

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