Ligand name: (2R,3S,4R)-3-(4'-chloro-2',6'-difluoro[1,1'-biphenyl]-4-yl)-4-(fluoromethyl)azetidine-2-carbonitrile
PDB ligand accession: H9V
DrugBank: n/a
PubChem: 134613163
ChEMBL: n/a
InChI Key: XHUZEPHBFHVYMY-YQQAZPJKSA-N
SMILES: c1cc(ccc1c2c(cc(cc2F)Cl)F)C3C(NC3C#N)CF
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
6UAP	Download	Experimental	e6uapA1 e6uapB1 e6uapB2 e6uapD1 e6uapD2 e6uapC1 e6uapE1 e6uapF1 e6uapF2 e6uapG1 e6uapH1 e6uapH2	TIM beta/alpha-barrel Rossmann-like Rossmann-like Rossmann-like Rossmann-like TIM beta/alpha-barrel TIM beta/alpha-barrel Rossmann-like Rossmann-like TIM beta/alpha-barrel Rossmann-like Rossmann-like	LigPlot
6UB9	Download	Experimental	e6ub9A1 e6ub9B1 e6ub9B2 e6ub9C1 e6ub9D1 e6ub9D2 e6ub9E1 e6ub9F1 e6ub9F2 e6ub9G1 e6ub9H1 e6ub9H2	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