Ligand name: (2S)-2-[[4-[[2,4-bis(azanyl)-6-oxidanylidene-1H-pyrimidin-5-yl]carbamoylamino]phenyl]carbonylamino]pentanedioic acid
PDB ligand accession: 9L9
DrugBank: n/a
PubChem: 60138154;135566650;
ChEMBL: CHEMBL3622702
InChI Key: WBQDVZMETQWVQD-VIFPVBQESA-N
SMILES: c1cc(ccc1C(=O)NC(CCC(=O)O)C(=O)O)NC(=O)NC2=C(N=C(NC2=O)N)N
Drug action: n/a

ClassyFire chemical classification:

• Kingdom: Organic compounds
  • Superclass: Organic acids and derivatives
    • Class: Carboxylic acids and derivatives
      • Subclass: Amino acids, peptides, and analogues

List of PDB structures and/or AlphaFold models with target protein D0CBC8

PDB/AF Accession	PyMOL script	Experimental / Predicted	Interacting ECOD domains	ECOD X-group name	LigPlot
4B4W	Download	Experimental	e4b4wA3 e4b4wA4 e4b4wB3 e4b4wB4	Rossmann-like Flavodoxin-like Rossmann-like Flavodoxin-like	LigPlot