Ligand name: 3-[(3-{[3-(METHYLAMINO)PROPYL]AMINO}PROPYL)AMINO]PROPANE-1,1-DIOL
PDB ligand accession: NBA
DrugBank: n/a
PubChem: 5183172
ChEMBL: n/a
InChI Key: PTLIEDFKZYQZEI-UHFFFAOYSA-N
SMILES: CNCCCNCCCNCCC(O)O
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 O64411

PDB/AF Accession	PyMOL script	Experimental / Predicted	Interacting ECOD domains	ECOD X-group name	LigPlot
1H84	Download	Experimental	e1h84A1 e1h84A2 e1h84B1 e1h84B2 e1h84C1 e1h84C2	FAD-linked reductases, C-terminal domain-like Rossmann-like FAD-linked reductases, C-terminal domain-like Rossmann-like FAD-linked reductases, C-terminal domain-like Rossmann-like	LigPlot
1H86	Download	Experimental	e1h86A1 e1h86A2 e1h86B1 e1h86B2 e1h86C1 e1h86C2	FAD-linked reductases, C-terminal domain-like Rossmann-like FAD-linked reductases, C-terminal domain-like Rossmann-like FAD-linked reductases, C-terminal domain-like Rossmann-like	LigPlot