Ligand name: 6-ACETAMIDO-6-DEOXY-CASTANOSPERMINE
PDB ligand accession: GC2
DrugBank: n/a
PubChem: 9837515
ChEMBL: CHEMBL1232979
InChI Key: IHKWXDCSAKJQKM-SRQGCSHVSA-N
SMILES: CC(=O)NC1CN2CCC(C2C(C1O)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 B3TLD6

PDB/AF Accession	PyMOL script	Experimental / Predicted	Interacting ECOD domains	ECOD X-group name	LigPlot
5BXS	Download	Experimental	e5bxsA3 e5bxsB3	TIM beta/alpha-barrel TIM beta/alpha-barrel	LigPlot