Ligand name: (3R,4R,5S)-4-(acetylamino)-5-amino-3-(pentan-3-yloxy)cyclohex-1-ene-1-carboxylic acid
PDB ligand accession: G39
DrugBank: DB02600
PubChem: 449381;44310478;
ChEMBL: CHEMBL674
InChI Key: NENPYTRHICXVCS-YNEHKIRRSA-N
SMILES: CCC(CC)OC1C=C(CC(C1NC(=O)C)N)C(=O)O
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 Q194T1

PDB/AF Accession	PyMOL script	Experimental / Predicted	Interacting ECOD domains	ECOD X-group name	LigPlot
4K1I	Download	Experimental	e4k1iA1 e4k1iB1	beta-propeller-like beta-propeller-like	LigPlot
4K1K	Download	Experimental	e4k1kA1 e4k1kB1	beta-propeller-like beta-propeller-like	LigPlot
4K1J	Download	Experimental	e4k1jA1 e4k1jB1	beta-propeller-like beta-propeller-like	LigPlot