Ligand name: S-HEXYLGLUTATHIONE
PDB ligand accession: GTX
DrugBank: n/a
PubChem: 445875
ChEMBL: n/a
InChI Key: HXJDWCWJDCOHDG-RYUDHWBXSA-O
SMILES: CCCCCCSCC(C(=O)NCC(=O)O)NC(=O)CCC(C(=O)O)[NH3+]
Drug action: n/a

ClassyFire chemical classification:

• Kingdom: Organic compounds
  • Superclass: Organic acids and derivatives
    • Class: Carboxylic acids and derivatives
      • Subclass: Amino acids, peptides, and analogues

List of PDB structures and/or AlphaFold models with target protein Q9Y2Q3

PDB/AF Accession	PyMOL script	Experimental / Predicted	Interacting ECOD domains	ECOD X-group name	LigPlot
3RPN	Download	Experimental	e3rpnA1 e3rpnA2 e3rpnD1 e3rpnD2 e3rpnB1 e3rpnB2 e3rpnE1 e3rpnE2 e3rpnC1 e3rpnC2 e3rpnF1 e3rpnF2	Insertion subdomain in DsbA-like Thioredoxin-like Insertion subdomain in DsbA-like Thioredoxin-like Insertion subdomain in DsbA-like Thioredoxin-like Insertion subdomain in DsbA-like Thioredoxin-like Insertion subdomain in DsbA-like Thioredoxin-like Insertion subdomain in DsbA-like Thioredoxin-like	LigPlot