Ligand name: METHYLLYCACONITINE
PDB ligand accession: MLK
DrugBank: n/a
PubChem: 5288811
ChEMBL: CHEMBL4454983
InChI Key: XLTANAWLDBYGFU-VTLKBQQISA-N
SMILES: CCN1CC2(CCC(C34C2C(C(C31)(C5(CC(C6CC4C5C6OC)OC)O)O)OC)OC)COC(=O)c7ccccc7N8C(=O)CC(C8=O)C
Drug action: n/a

ClassyFire chemical classification:

• Kingdom: Organic compounds
  • Superclass: Lipids and lipid-like molecules
    • Class: Prenol lipids
      • Subclass: Diterpenoids

List of PDB structures and/or AlphaFold models with target protein Q9UGM1

PDB/AF Accession	PyMOL script	Experimental / Predicted	Interacting ECOD domains	ECOD X-group name	LigPlot
4UXU	Download	Experimental	e4uxuA1 e4uxuB1	Immunoglobulin-like beta-sandwich Immunoglobulin-like beta-sandwich	LigPlot