Ligand name: S-octylglutathione
PDB ligand accession: GTY
DrugBank: DB03032
InChI Key: MJWCZWAVSJZQNL-KBPBESRZSA-N
SMILES: CCCCCCCCSCC(C(=O)NCC(=O)O)NC(=O)CCC(C(=O)O)N
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 Q03013

PDB/AF Accession	PyMOL script	Experimental / Predicted	Interacting ECOD domains	ECOD X-group name
Q03013	Download	Predicted	Q03013_F1_nD1	Repetitive alpha hairpins
4GTU		Predicted	e4gtuA1 e4gtuB1 e4gtuC1 e4gtuD1 e4gtuE1 e4gtuF1 e4gtuG1 e4gtuH1 e4gtuF2 e4gtuH2 e4gtuD2 e4gtuE2 e4gtuB2 e4gtuG2 e4gtuC2 e4gtuA2