Ligand name: (2R)-2-{4-[(2S)-4-[(6-aminopyridin-3-yl)sulfonyl]-2-(prop-1-yn-1-yl)piperazin-1-yl]phenyl}-1,1,1-trifluorohex-4-yn-2-ol
PDB ligand accession: 2TE
DrugBank: n/a
PubChem: 78350451
ChEMBL: n/a
InChI Key: DWZSLEBNXFXVGP-NZQKXSOJSA-N
SMILES: CC#CCC(c1ccc(cc1)N2CCN(CC2C#CC)S(=O)(=O)c3ccc(nc3)N)(C(F)(F)F)O
Drug action: n/a

ClassyFire chemical classification:

• Kingdom: Organic compounds
  • Superclass: Organoheterocyclic compounds
    • Class: Diazinanes
      • Subclass: Piperazines

List of PDB structures and/or AlphaFold models with target protein Q14397

PDB/AF Accession	PyMOL script	Experimental / Predicted	Interacting ECOD domains	ECOD X-group name	LigPlot
4OHK	Download	Experimental	e4ohkA2 e4ohkA3 e4ohkB2 e4ohkB3	RuvA-C Flavodoxin-like Flavodoxin-like RuvA-C	LigPlot