Ligand name: 2-(2-aminopyridin-1-ium-1-yl)ethanol
PDB ligand accession: 1LN
DrugBank: n/a
PubChem: n/a
ChEMBL: n/a
InChI Key: BFRGFNNQJWMZSX-UHFFFAOYSA-N
SMILES: C1=CC=[N](C(=C1)N)CCO
Drug action: n/a

ClassyFire chemical classification:

• Kingdom: Organic compounds
  • Superclass: Organoheterocyclic compounds
    • Class: Pyridines and derivatives
      • Subclass: Hydropyridines

List of PDB structures and/or AlphaFold models with target protein B3LRE1

PDB/AF Accession	PyMOL script	Experimental / Predicted	Interacting ECOD domains	ECOD X-group name	LigPlot
4JQK	Download	Experimental	e4jqkA1	Heme-dependent peroxidases	LigPlot