Ligand name: ACETONITRILE
PDB ligand accession: CCN
DrugBank: n/a
PubChem: 6342
ChEMBL: CHEMBL45211
InChI Key: WEVYAHXRMPXWCK-UHFFFAOYSA-N
SMILES: CC#N
Drug action: n/a

ClassyFire chemical classification:

• Kingdom: Organic compounds
  • Superclass: Organic nitrogen compounds
    • Class: Organonitrogen compounds
      • Subclass: Organic cyanides

List of PDB structures and/or AlphaFold models with target protein A0A074MDU6

PDB/AF Accession	PyMOL script	Experimental / Predicted	Interacting ECOD domains	ECOD X-group name	LigPlot
7W8N	Download	Experimental	e7w8nA1 e7w8nB1 e7w8nB1 e7w8nD1 e7w8nC1 e7w8nD1	alpha/beta-Hydrolases alpha/beta-Hydrolases alpha/beta-Hydrolases alpha/beta-Hydrolases alpha/beta-Hydrolases alpha/beta-Hydrolases	LigPlot
7CIP	Download	Experimental	e7cipA1 e7cipB1 e7cipB1 e7cipC1 e7cipD1	alpha/beta-Hydrolases alpha/beta-Hydrolases alpha/beta-Hydrolases alpha/beta-Hydrolases alpha/beta-Hydrolases	LigPlot