Ligand name: (2S,3R,4S,5S)-2-methyl-5-(phenylethynyl)pyrrolidine-3,4-diol
PDB ligand accession: 2M7
DrugBank: n/a
PubChem: 75277393
ChEMBL: n/a
InChI Key: RPIQJUPODSDSQH-SYEHKZFSSA-N
SMILES: CC1C(C(C(N1)C#Cc2ccccc2)O)O
Drug action: n/a

ClassyFire chemical classification:

• Kingdom: Organic compounds
  • Superclass: Benzenoids
    • Class: Benzene and substituted derivatives
      • Subclass: None

List of PDB structures and/or AlphaFold models with target protein Q8A3I4

PDB/AF Accession	PyMOL script	Experimental / Predicted	Interacting ECOD domains	ECOD X-group name	LigPlot
4PCS	Download	Experimental	e4pcsA2 e4pcsB2 e4pcsC2 e4pcsD2	TIM beta/alpha-barrel TIM beta/alpha-barrel TIM beta/alpha-barrel TIM beta/alpha-barrel	LigPlot