Ligand name: 4-NITROCATECHOL
PDB ligand accession: 4NC
DrugBank: DB03407
PubChem: 3505109
ChEMBL: CHEMBL42423
InChI Key: XJNPNXSISMKQEX-UHFFFAOYSA-N
SMILES: c1cc(c(cc1[N+](=O)[O-])O)O
Drug action: n/a

ClassyFire chemical classification:

• Kingdom: Organic compounds
  • Superclass: Benzenoids
    • Class: Phenols
      • Subclass: Nitrophenols

List of PDB structures and/or AlphaFold models with target protein P20372

PDB/AF Accession	PyMOL script	Experimental / Predicted	Interacting ECOD domains	ECOD X-group name	LigPlot
1EOC	Download	Experimental	e1eocA1 e1eocB1	Immunoglobulin-like beta-sandwich Immunoglobulin-like beta-sandwich	LigPlot
2BUZ	Download	Experimental	e2buzA1 e2buzB1	Immunoglobulin-like beta-sandwich Immunoglobulin-like beta-sandwich	LigPlot
2BUU	Download	Experimental	e2buuA1 e2buuB1	Immunoglobulin-like beta-sandwich Immunoglobulin-like beta-sandwich	LigPlot