Ligand name: ACETYLTHIOCHOLINE
PDB ligand accession: AT3
DrugBank: n/a
PubChem: 20544
ChEMBL: CHEMBL1231076
InChI Key: GFFIJCYHQYHUHB-UHFFFAOYSA-N
SMILES: CC(=O)SCC[N+](C)(C)C
Drug action: n/a

ClassyFire chemical classification:

• Kingdom: Organic compounds
  • Superclass: Organic nitrogen compounds
    • Class: Organonitrogen compounds
      • Subclass: Quaternary ammonium salts

List of PDB structures and/or AlphaFold models with target protein Q9HUP2

PDB/AF Accession	PyMOL script	Experimental / Predicted	Interacting ECOD domains	ECOD X-group name	LigPlot
6UR1	Download	Experimental	e6ur1A1 e6ur1B1	Flavodoxin-like Flavodoxin-like	LigPlot
8D8Y	Download	Experimental	e8d8yA1 e8d8yB1	Flavodoxin-like Flavodoxin-like	LigPlot
6UQY	Download	Experimental	e6uqyA1 e6uqyB1	Flavodoxin-like Flavodoxin-like	LigPlot