Ligand name: 2-[3-(2-HYDROXY-1,1-DIHYDROXYMETHYL-ETHYLAMINO)-PROPYLAMINO]-2-HYDROXYMETHYL-PROPANE-1,3-DIOL
PDB ligand accession: B3P
DrugBank: DB02676
PubChem: 125132
ChEMBL: CHEMBL63859
InChI Key: HHKZCCWKTZRCCL-UHFFFAOYSA-N
SMILES: C(CNC(CO)(CO)CO)CNC(CO)(CO)CO
Drug action: n/a

ClassyFire chemical classification:

• Kingdom: Organic compounds
  • Superclass: Organic nitrogen compounds
    • Class: Organonitrogen compounds
      • Subclass: Amines

List of PDB structures and/or AlphaFold models with target protein M1E1E9

PDB/AF Accession	PyMOL script	Experimental / Predicted	Interacting ECOD domains	ECOD X-group name	LigPlot
4AQ0	Download	Experimental	e4aq0A5 e4aq0A2	Glycosyl hydrolase domain-like Repetitive alpha hairpins	LigPlot