Ligand name: 5-{2-[1-(tert-butoxycarbonyl)-2,3-dihydro-1H-indol-5-yl]ethyl}-2,6-dioxo-1,2,3,6-tetrahydropyrimidine-4-carboxylic acid
PDB ligand accession: W7Q
DrugBank: n/a
PubChem: 73010376
ChEMBL: CHEMBL3990159
InChI Key: LMLPIUXNXKWZHD-UHFFFAOYSA-N
SMILES: CC(C)(C)OC(=O)N1CCc2c1ccc(c2)CCC3=C(NC(=O)NC3=O)C(=O)O
Drug action: n/a

ClassyFire chemical classification:

• Kingdom: Organic compounds
  • Superclass: Organoheterocyclic compounds
    • Class: Indoles and derivatives
      • Subclass: Indolecarboxylic acids and 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
3W7Q	Download	Experimental	e3w7qA1 e3w7qB1	TIM beta/alpha-barrel TIM beta/alpha-barrel	LigPlot