Ligand name: (4aR,6R,8aS)-8a-(2,4-difluorophenyl)-6-(1-methyl-1H-pyrazol-4-yl)-4,4a,5,6,8,8a-hexahydropyrano[3,4-d][1,3]thiazin-2-amine
PDB ligand accession: SI5
DrugBank: n/a
PubChem: 72547320
ChEMBL: CHEMBL3422238
InChI Key: JYDYMWJEZLKIBS-CXMBCZLWSA-N
SMILES: Cn1cc(cn1)C2CC3CSC(=NC3(CO2)c4ccc(cc4F)F)N
Drug action: n/a

ClassyFire chemical classification:

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

List of PDB structures and/or AlphaFold models with target protein P56817

PDB/AF Accession	PyMOL script	Experimental / Predicted	Interacting ECOD domains	ECOD X-group name	LigPlot
4XXS	Download	Experimental	e4xxsA1 e4xxsA2	cradle loop barrel cradle loop barrel	LigPlot