Ligand name: GLUTATHIONE
PDB ligand accession: GSH
DrugBank: DB00143
PubChem: 124886;25246407;171390563;
ChEMBL: CHEMBL1543
InChI Key: RWSXRVCMGQZWBV-WDSKDSINSA-N
SMILES: C(CC(=O)NC(CS)C(=O)NCC(=O)O)C(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 drug binding-associated PTMs

List of PDB structures and/or AlphaFold models with target protein P08263

PDB/AF Accession	PyMOL script	Experimental / Predicted	Interacting ECOD domains	ECOD X-group name	LigPlot
1PKW	Download	Experimental	e1pkwA2 e1pkwB1 e1pkwA1 e1pkwB2 e1pkwB1 e1pkwA1	Thioredoxin-like Repetitive alpha hairpins Repetitive alpha hairpins Thioredoxin-like Repetitive alpha hairpins Repetitive alpha hairpins	LigPlot
3I6A	Download	Experimental	e3i6aA1 e3i6aA2 e3i6aB1 e3i6aA1 e3i6aB1 e3i6aB2 e3i6aC1 e3i6aC2 e3i6aD1 e3i6aC1 e3i6aD1 e3i6aD2 e3i6aE1 e3i6aE2 e3i6aF1 e3i6aE1 e3i6aE2 e3i6aF1 e3i6aF2 e3i6aG1 e3i6aG2 e3i6aH1 e3i6aG1 e3i6aG2 e3i6aH1 e3i6aH2	Repetitive alpha hairpins Thioredoxin-like Repetitive alpha hairpins Repetitive alpha hairpins Repetitive alpha hairpins Thioredoxin-like Repetitive alpha hairpins Thioredoxin-like Repetitive alpha hairpins Repetitive alpha hairpins Repetitive alpha hairpins Thioredoxin-like Repetitive alpha hairpins Thioredoxin-like Repetitive alpha hairpins Repetitive alpha hairpins Thioredoxin-like Repetitive alpha hairpins Thioredoxin-like Repetitive alpha hairpins Thioredoxin-like Repetitive alpha hairpins Repetitive alpha hairpins Thioredoxin-like Repetitive alpha hairpins Thioredoxin-like	LigPlot
5LCZ	Download	Experimental	e5lczA1 e5lczB2	Thioredoxin-like Repetitive alpha hairpins	LigPlot
1GSE	Download	Experimental	e1gseA2 e1gseB1 e1gseA1 e1gseB2 e1gseB1 e1gseA1	Thioredoxin-like Repetitive alpha hairpins Repetitive alpha hairpins Thioredoxin-like Repetitive alpha hairpins Repetitive alpha hairpins	LigPlot
1USB	Download	Experimental	e1usbA2 e1usbB1 e1usbB2 e1usbA1	Thioredoxin-like Repetitive alpha hairpins Thioredoxin-like Repetitive alpha hairpins	LigPlot
6ATO	Download	Experimental	e6atoA1 e6atoA2 e6atoB1 e6atoA2 e6atoB1 e6atoB2	Thioredoxin-like Repetitive alpha hairpins Repetitive alpha hairpins Repetitive alpha hairpins Repetitive alpha hairpins Thioredoxin-like	LigPlot
3I69	Download	Experimental	e3i69A1 e3i69B1 e3i69B2 e3i69C1 e3i69D1 e3i69D2	Repetitive alpha hairpins Repetitive alpha hairpins Thioredoxin-like Repetitive alpha hairpins Repetitive alpha hairpins Thioredoxin-like	LigPlot