Ligand name: 2-(2-azanylethylamino)-5-nitro-benzoic acid
PDB ligand accession: C8O
DrugBank: n/a
PubChem: 3143423;7183567;
ChEMBL: n/a
InChI Key: PGIQBPZLZVDGHP-UHFFFAOYSA-N
SMILES: c1cc(c(cc1[N+](=O)[O-])C(=O)O)NCCN
Drug action: n/a

ClassyFire chemical classification:

• Kingdom: Organic compounds
  • Superclass: Benzenoids
    • Class: Benzene and substituted derivatives
      • Subclass: Benzoic acids and derivatives

List of PDB structures and/or AlphaFold models with target protein B2RID1

PDB/AF Accession	PyMOL script	Experimental / Predicted	Interacting ECOD domains	ECOD X-group name	LigPlot
6JTC	Download	Experimental	e6jtcA1 e6jtcA2 e6jtcB1 e6jtcB2	cradle loop barrel Helical bundle domain in S46 peptidase cradle loop barrel Helical bundle domain in S46 peptidase	LigPlot