Ligand name: 3-HYDROXY-5-(HYDROXYMETHYL)-2-METHYLISONICOTINALDEHYDE
PDB ligand accession: PXL
DrugBank: DB00147
PubChem: 1050
ChEMBL: CHEMBL102970
InChI Key: RADKZDMFGJYCBB-UHFFFAOYSA-N
SMILES: Cc1c(c(c(cn1)CO)C=O)O
Drug action: n/a

ClassyFire chemical classification:

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

List of PDB structures and/or AlphaFold models with target protein Q89ZB9

PDB/AF Accession	PyMOL script	Experimental / Predicted	Interacting ECOD domains	ECOD X-group name	LigPlot
3MBH	Download	Experimental	e3mbhA1 e3mbhB1 e3mbhC1 e3mbhD1 e3mbhE1 e3mbhF1	Rossmann-like Rossmann-like Rossmann-like Rossmann-like Rossmann-like Rossmann-like	LigPlot