Ligand name: (2R,3S,4R)-3-(2'-fluoro[1,1'-biphenyl]-4-yl)-4-(hydroxymethyl)azetidine-2-carbonitrile
PDB ligand accession: 79V
DrugBank: n/a
PubChem: 54650477
ChEMBL: CHEMBL4440470
InChI Key: RECLLIAWOQFAMC-ULQDDVLXSA-N
SMILES: c1ccc(c(c1)c2ccc(cc2)C3C(NC3C#N)CO)F
Drug action: n/a

ClassyFire chemical classification:

• Kingdom: Organic compounds
  • Superclass: Benzenoids
    • Class: Benzene and substituted derivatives
      • Subclass: Biphenyls and derivatives

List of PDB structures and/or AlphaFold models with target protein P9WFY1

PDB/AF Accession	PyMOL script	Experimental / Predicted	Interacting ECOD domains	ECOD X-group name	LigPlot
5TCJ	Download	Experimental	e5tcjA1 e5tcjB1 e5tcjB2 e5tcjG1 e5tcjH1 e5tcjH2 e5tcjE1 e5tcjF1 e5tcjF2 e5tcjC1 e5tcjD1 e5tcjD2	TIM beta/alpha-barrel Rossmann-like Rossmann-like TIM beta/alpha-barrel Rossmann-like Rossmann-like TIM beta/alpha-barrel Rossmann-like Rossmann-like TIM beta/alpha-barrel Rossmann-like Rossmann-like	LigPlot
5TCI	Download	Experimental	e5tciA1 e5tciB1 e5tciB2 e5tciG1 e5tciH1 e5tciH2 e5tciE1 e5tciF1 e5tciF2 e5tciC1 e5tciD1 e5tciD2	TIM beta/alpha-barrel Rossmann-like Rossmann-like TIM beta/alpha-barrel Rossmann-like Rossmann-like TIM beta/alpha-barrel Rossmann-like Rossmann-like TIM beta/alpha-barrel Rossmann-like Rossmann-like	LigPlot