Ligand name: 1-[({2,4-BIS[(E)-(HYDROXYIMINO)METHYL]PYRIDINIUM-1-YL}METHOXY)METHYL]-4-CARBAMOYLPYRIDINIUM
PDB ligand accession: HLO
DrugBank: n/a
PubChem: 108049;6308540;6849545;16214796;52947981;101601748;135398751;135520674;135666470;135752462;135889861;138397604;139031161;161501644;172916187;
ChEMBL: CHEMBL1233344
InChI Key: SODKCPHRJDOHMI-UHFFFAOYSA-P
SMILES: c1c[n+](ccc1C(=O)N)COC[n+]2ccc(cc2C=NO)C=NO
Drug action: n/a

ClassyFire chemical classification:

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

List of PDB structures and/or AlphaFold models with target protein P21836

PDB/AF Accession	PyMOL script	Experimental / Predicted	Interacting ECOD domains	ECOD X-group name	LigPlot
2JEZ	Download	Experimental	e2jezA1 e2jezB1	alpha/beta-Hydrolases alpha/beta-Hydrolases	LigPlot
2JEY	Download	Experimental	e2jeyA1 e2jeyB1	alpha/beta-Hydrolases alpha/beta-Hydrolases	LigPlot