Ligand name: (2E)-3-phenylprop-2-enal
PDB ligand accession: 9Y6
DrugBank: DB14184
PubChem: 637511
ChEMBL: CHEMBL293492
InChI Key: KJPRLNWUNMBNBZ-QPJJXVBHSA-N
SMILES: c1ccc(cc1)C=CC=O
Drug action: n/a

ClassyFire chemical classification:

• Kingdom: Organic compounds
  • Superclass: Phenylpropanoids and polyketides
    • Class: Cinnamaldehydes
      • Subclass: None

List of PDB structures and/or AlphaFold models with target protein V0AAC4

PDB/AF Accession	PyMOL script	Experimental / Predicted	Interacting ECOD domains	ECOD X-group name	LigPlot
7P76	Download	Experimental	e7p76A1 e7p76B1 e7p76C1 e7p76D1 e7p76E1 e7p76F1 e7p76G1 e7p76H1 e7p76I1 e7p76J1 e7p76K1 e7p76L1	TIM beta/alpha-barrel TIM beta/alpha-barrel TIM beta/alpha-barrel TIM beta/alpha-barrel TIM beta/alpha-barrel TIM beta/alpha-barrel TIM beta/alpha-barrel TIM beta/alpha-barrel TIM beta/alpha-barrel TIM beta/alpha-barrel TIM beta/alpha-barrel TIM beta/alpha-barrel	LigPlot