Ligand name: ACETONE
PDB ligand accession: ACN
DrugBank: n/a
PubChem: 180
ChEMBL: CHEMBL14253
InChI Key: CSCPPACGZOOCGX-UHFFFAOYSA-N
SMILES: CC(=O)C
Drug action: n/a

ClassyFire chemical classification:

• Kingdom: Organic compounds
  • Superclass: Organic oxygen compounds
    • Class: Organooxygen compounds
      • Subclass: Carbonyl compounds

List of PDB structures and/or AlphaFold models with target protein P39045

PDB/AF Accession	PyMOL script	Experimental / Predicted	Interacting ECOD domains	ECOD X-group name	LigPlot
3ZVW	Download	Experimental	e3zvwB2 e3zvwB3 e3zvwB4 e3zvwC2 e3zvwC3 e3zvwC4	alpha-helical domain in beta-lactamase/transpeptidase-like proteins Profilin-like DTD-like alpha-helical domain in beta-lactamase/transpeptidase-like proteins Profilin-like DTD-like	LigPlot
2Y55	Download	Experimental	e2y55A2 e2y55A3 e2y55A4 e2y55B2 e2y55B3 e2y55B4 e2y55C2 e2y55C3 e2y55C4 e2y55D2 e2y55D4	alpha-helical domain in beta-lactamase/transpeptidase-like proteins Profilin-like DTD-like alpha-helical domain in beta-lactamase/transpeptidase-like proteins Profilin-like DTD-like alpha-helical domain in beta-lactamase/transpeptidase-like proteins Profilin-like DTD-like alpha-helical domain in beta-lactamase/transpeptidase-like proteins DTD-like	LigPlot