Ligand name: 2-nitrobenzene-1,3-diol
PDB ligand accession: 38L
DrugBank: n/a
PubChem: 11760
ChEMBL: n/a
InChI Key: ZLCPKMIJYMHZMJ-UHFFFAOYSA-N
SMILES: c1cc(c(c(c1)O)[N+](=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 Q12BV1

PDB/AF Accession	PyMOL script	Experimental / Predicted	Interacting ECOD domains	ECOD X-group name	LigPlot
4QRO	Download	Experimental	e4qroA1 e4qroB1 e4qroC1 e4qroD1 e4qroE1 e4qroF1 e4qroG1 e4qroH1	TIM beta/alpha-barrel TIM beta/alpha-barrel TIM beta/alpha-barrel TIM beta/alpha-barrel TIM beta/alpha-barrel TIM beta/alpha-barrel TIM beta/alpha-barrel TIM beta/alpha-barrel	LigPlot