Ligand name: CASTANOSPERMINE
PDB ligand accession: CTS
DrugBank: DB01816
PubChem: 54445
ChEMBL: CHEMBL311226
InChI Key: JDVVGAQPNNXQDW-TVNFTVLESA-N
SMILES: C1CN2CC(C(C(C2C1O)O)O)O
Drug action: n/a

ClassyFire chemical classification:

• Kingdom: Organic compounds
  • Superclass: Organoheterocyclic compounds
    • Class: Indolizidines
      • Subclass: None

List of PDB structures and/or AlphaFold models with target protein Q2PS28

PDB/AF Accession	PyMOL script	Experimental / Predicted	Interacting ECOD domains	ECOD X-group name	LigPlot
2PWG	Download	Experimental	e2pwgA2 e2pwgB2	TIM beta/alpha-barrel TIM beta/alpha-barrel	LigPlot