Ligand name: 1,3-bis(sulfanyl)propan-2-one
PDB ligand accession: I1J
DrugBank: n/a
PubChem: 308054
ChEMBL: n/a
InChI Key: QCBZCEKWIGTIMT-UHFFFAOYSA-N
SMILES: C(C(=O)CS)S
Drug action: n/a

ClassyFire chemical classification:

• Kingdom: Organic compounds
  • Superclass: Organic oxygen compounds
    • Class: Organooxygen compounds
      • Subclass: Carbonyl compounds

List of PDB structures and/or AlphaFold models with target protein Q9UNE7

PDB/AF Accession	PyMOL script	Experimental / Predicted	Interacting ECOD domains	ECOD X-group name	LigPlot
7TB1	Download	Experimental	e7tb1B1 e7tb1A1	Repetitive alpha hairpins Repetitive alpha hairpins	LigPlot