Ligand name: 2-{3-[(4-AMINO-2-METHYLPYRIMIDIN-5-YL)METHYL]-4-METHYL-2-OXO-2,3-DIHYDRO-1,3-THIAZOL-5-YL}ETHYL TRIHYDROGEN DIPHOSPHATE
PDB ligand accession: TZD
DrugBank: n/a
PubChem: 124687
ChEMBL: CHEMBL403021
InChI Key: ZGJUYGIRPQSCFA-UHFFFAOYSA-N
SMILES: Cc1ncc(c(n1)N)CN2C(=C(SC2=O)CCOP(=O)(O)OP(=O)(O)O)C
Drug action: n/a

ClassyFire chemical classification:

• Kingdom: Organic compounds
  • Superclass: Organic oxygen compounds
    • Class: Organic oxoanionic compounds
      • Subclass: Organic pyrophosphates

List of PDB structures and/or AlphaFold models with target protein P17597

PDB/AF Accession	PyMOL script	Experimental / Predicted	Interacting ECOD domains	ECOD X-group name	LigPlot
5K6T	Download	Experimental	e5k6tA2	Thiamin diphosphate-binding fold (THDP-binding)	LigPlot
7U25	Download	Experimental	e7u25A3	Thiamin diphosphate-binding fold (THDP-binding)	LigPlot
7STQ	Download	Experimental	e7stqA2	Thiamin diphosphate-binding fold (THDP-binding)	LigPlot
5K6R	Download	Experimental	e5k6rA2	Thiamin diphosphate-binding fold (THDP-binding)	LigPlot