Ligand name: (1~{R},9~{S})-5-(3-oxidanylpropyl)-7,11-diazatricyclo[7.3.1.0^{2,7}]trideca-2,4-dien-6-one
PDB ligand accession: MXQ
DrugBank: n/a
PubChem: 145946088
ChEMBL: n/a
InChI Key: JXEXVCIRYVIYEW-CMPLNLGQSA-N
SMILES: C1C2CNCC1C3=CC=C(C(=O)N3C2)CCCO
Drug action: n/a

ClassyFire chemical classification:

• Kingdom: Organic compounds
  • Superclass: Alkaloids and derivatives
    • Class: Lupin alkaloids
      • Subclass: Cytisine and derivatives

List of PDB structures and/or AlphaFold models with target protein Q8WSF8

PDB/AF Accession	PyMOL script	Experimental / Predicted	Interacting ECOD domains	ECOD X-group name	LigPlot
6T9R	Download	Experimental	e6t9rAAA1 e6t9rDDD1 e6t9rBBB1 e6t9rEEE1 e6t9rAAA1 e6t9rCCC1 e6t9rBBB1 e6t9rDDD1 e6t9rCCC1 e6t9rEEE1 e6t9rFFF1 e6t9rHHH1 e6t9rFFF1 e6t9rGGG1 e6t9rHHH1 e6t9rIII1 e6t9rIII1 e6t9rJJJ1 e6t9rGGG1 e6t9rJJJ1	Immunoglobulin-like beta-sandwich Immunoglobulin-like beta-sandwich Immunoglobulin-like beta-sandwich Immunoglobulin-like beta-sandwich Immunoglobulin-like beta-sandwich Immunoglobulin-like beta-sandwich Immunoglobulin-like beta-sandwich Immunoglobulin-like beta-sandwich Immunoglobulin-like beta-sandwich Immunoglobulin-like beta-sandwich Immunoglobulin-like beta-sandwich Immunoglobulin-like beta-sandwich Immunoglobulin-like beta-sandwich Immunoglobulin-like beta-sandwich Immunoglobulin-like beta-sandwich Immunoglobulin-like beta-sandwich Immunoglobulin-like beta-sandwich Immunoglobulin-like beta-sandwich Immunoglobulin-like beta-sandwich Immunoglobulin-like beta-sandwich	LigPlot