Ligand name: (2~{R})-2-[[6-ethyl-5-(1~{H}-indol-5-yl)thieno[2,3-d]pyrimidin-4-yl]amino]propanoic acid
PDB ligand accession: JKQ
DrugBank: n/a
PubChem: 138756809
ChEMBL: CHEMBL4450405
InChI Key: QOISOOHIVJLDFS-SNVBAGLBSA-N
SMILES: CCc1c(c2c(ncnc2s1)NC(C)C(=O)O)c3ccc4c(c3)cc[nH]4
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 P0AEY0

PDB/AF Accession	PyMOL script	Experimental / Predicted	Interacting ECOD domains	ECOD X-group name	LigPlot
6QXJ	Download	Experimental	e6qxjA2	Toxins' membrane translocation domains	LigPlot