Ligand name: CHOLINE ION
PDB ligand accession: CHT
DrugBank: DB00122
PubChem: 305
ChEMBL: CHEMBL920
InChI Key: OEYIOHPDSNJKLS-UHFFFAOYSA-N
SMILES: C[N+](C)(C)CCO
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 Q8DR52

PDB/AF Accession	PyMOL script	Experimental / Predicted	Interacting ECOD domains	ECOD X-group name	LigPlot
7BAY	Download	Experimental	e7bayAA1	beta-hairpin stack	LigPlot
2X8M	Download	Experimental	e2x8mA1	beta-hairpin stack	LigPlot
2VYU	Download	Experimental	e2vyuA1	beta-hairpin stack	LigPlot
2X8O	Download	Experimental	e2x8oA1	beta-hairpin stack	LigPlot
2X8P	Download	Experimental	e2x8pA1	beta-hairpin stack	LigPlot
2V05	Download	Experimental	e2v05A1	beta-hairpin stack	LigPlot
2V04	Download	Experimental	e2v04A1	beta-hairpin stack	LigPlot