Structure of PDB 7zzn Chain A Binding Site BS01

Receptor Information
>7zzn Chain A (length=197) Species: 3694 (Populus trichocarpa) [Search protein sequence] [Download receptor structure] [Download structure with residue number starting from 1] [View receptor structure]
DVKLHGSWVSPFNYRVIWALKLKGVEFEHIVKIPVLVHGGKPIAESLVIL
EYIEETWPENPLLPTDPYERAMARFWIQYGATKTAAFGALFRASGEELEK
AAKEVVEVLRVLEEQGLGDKKFFGGDSINLVDISFGLFTCWLEAIEEAAG
VKVLEPSTLPRLHAWAQNFIEVPLIKENIPDYDKLLLHMKGVREKMM
Ligand information
Ligand IDCA
InChIInChI=1S/Ca/q+2
InChIKeyBHPQYMZQTOCNFJ-UHFFFAOYSA-N
SMILES
SoftwareSMILES
CACTVS 3.341[Ca++]
ACDLabs 10.04
OpenEye OEToolkits 1.5.0		[Ca+2]
FormulaCa
NameCALCIUM ION
ChEMBL
DrugBankDB14577
ZINC
PDB chain7zzn Chain A Residue 301 [Download ligand structure] [Download structure with residue number starting from 1] [View ligand structure]
Receptor-Ligand Complex Structure
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PDB7zzn Biochemical and Structural Insights on the Poplar Tau Glutathione Transferase GSTU19 and 20 Paralogs Binding Flavonoids.
Resolution2.01 Å
Binding residue
(original residue number in PDB)		L174 H183
Binding residue
(residue number reindexed from 1)		L154 H163
Annotation score1
Enzymatic activity
Enzyme Commision number 2.5.1.18: glutathione transferase.
Gene Ontology
Molecular Function
GO:0004364 glutathione transferase activity
GO:0016740 transferase activity
GO:0046872 metal ion binding
Biological Process
GO:0006749 glutathione metabolic process
Cellular Component
GO:0005737 cytoplasm

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Molecular Function
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Biological Process
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Cellular Component
External links
PDB RCSB:7zzn, PDBe:7zzn, PDBj:7zzn
PDBsum7zzn
PubMed36032685
UniProtD2X9R3

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