Ligand name: 5-(3,3-dimethylbutyl)-2,6-dioxo-1,2,3,6-tetrahydropyrimidine-4-carboxylic acid
PDB ligand accession: YRO
DrugBank: n/a
PubChem: 71816171
ChEMBL: n/a
InChI Key: HROWFJPIAGSCKL-UHFFFAOYSA-N
SMILES: CC(C)(C)CCC1=C(NC(=O)NC1=O)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 Q4D3W2

PDB/AF Accession	PyMOL script	Experimental / Predicted	Interacting ECOD domains	ECOD X-group name	LigPlot
3W1Q	Download	Experimental	e3w1qA1 e3w1qB1	TIM beta/alpha-barrel TIM beta/alpha-barrel	LigPlot