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 PDB structures and/or AlphaFold models with target protein Q49SB0

PDB/AF Accession	PyMOL script	Experimental / Predicted	Interacting ECOD domains	ECOD X-group name	LigPlot
7SO8	Download	Experimental	e7so8A1 e7so8A2 e7so8B2 e7so8C1 e7so8C2 e7so8D2 e7so8E1 e7so8E2 e7so8G1 e7so8G2 e7so8H1 e7so8H2 e7so8F1 e7so8F2 e7so8A1 e7so8A2 e7so8B1 e7so8B2 e7so8D1 e7so8D2	Thioredoxin-like Repetitive alpha hairpins Repetitive alpha hairpins Thioredoxin-like 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 Thioredoxin-like Repetitive alpha hairpins Thioredoxin-like Repetitive alpha hairpins Thioredoxin-like Repetitive alpha hairpins	LigPlot
5AN1	Download	Experimental	e5an1A1 e5an1A2 e5an1H1 e5an1B1 e5an1B2 e5an1G1 e5an1C1 e5an1C2 e5an1D2 e5an1E1 e5an1D1 e5an1E2 e5an1F1 e5an1F2 e5an1B1 e5an1G2 e5an1A1 e5an1A2 e5an1H2	Thioredoxin-like Repetitive alpha hairpins 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 Repetitive alpha hairpins Thioredoxin-like Thioredoxin-like Repetitive alpha hairpins Thioredoxin-like	LigPlot