Ligand name: Tetrahydrocolumbamine
PDB ligand accession: H68
DrugBank: n/a
PubChem: 440229
ChEMBL: CHEMBL2334891
InChI Key: KDFKJOFJHSVROC-INIZCTEOSA-N
SMILES: COc1ccc2c(c1OC)CN3CCc4cc(c(cc4C3C2)O)OC
Drug action: n/a

ClassyFire chemical classification:

• Kingdom: Organic compounds
  • Superclass: Alkaloids and derivatives
    • Class: Protoberberine alkaloids and derivatives
      • Subclass: None

List of PDB structures and/or AlphaFold models with target protein I3PLQ5

PDB/AF Accession	PyMOL script	Experimental / Predicted	Interacting ECOD domains	ECOD X-group name	LigPlot
6I6L	Download	Experimental	e6i6lA1 e6i6lA2 e6i6lB1 e6i6lA1 e6i6lB2	HTH Rossmann-like HTH HTH Rossmann-like	LigPlot