Ligand name: (2R)-2-(7-amino-1-methyl-4,5-dioxo-1,4,5,6-tetrahydropyrimido[4,5-c]pyridazin-3-yl)propanoic acid
PDB ligand accession: B52
DrugBank: n/a
PubChem: 44475967;135566467;
ChEMBL: n/a
InChI Key: XUKTUWRGSZSUGO-GSVOUGTGSA-N
SMILES: CC(C1=NN(C2=C(C1=O)C(=O)NC(=N2)N)C)C(=O)O
Drug action: n/a

ClassyFire chemical classification:

• Kingdom: Organic compounds
  • Superclass: Organoheterocyclic compounds
    • Class: Diazines
      • Subclass: Pyrimidines and pyrimidine derivatives

List of PDB structures and/or AlphaFold models with target protein B1UXN2

PDB/AF Accession	PyMOL script	Experimental / Predicted	Interacting ECOD domains	ECOD X-group name	LigPlot
3H21	Download	Experimental	e3h21A1 e3h21B1	TIM beta/alpha-barrel TIM beta/alpha-barrel	LigPlot