Ligand name: pyridin-3-ylmethyl trihydrogen diphosphate
PDB ligand accession: 2E4
DrugBank: n/a
PubChem: 46236604
ChEMBL: CHEMBL2251817
InChI Key: ZGCXLEIPHNIRMO-UHFFFAOYSA-N
SMILES: c1cc(cnc1)COP(=O)(O)OP(=O)(O)O
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 C9QSC3

PDB/AF Accession	PyMOL script	Experimental / Predicted	Interacting ECOD domains	ECOD X-group name	LigPlot
4MUX	Download	Experimental	e4muxA1 e4muxA2 e4muxA3 e4muxB1 e4muxB2 e4muxB3	NadA-like/4-hydroxy-3-methylbut-2-enyl diphosphate reductase NadA-like/4-hydroxy-3-methylbut-2-enyl diphosphate reductase NadA-like/4-hydroxy-3-methylbut-2-enyl diphosphate reductase NadA-like/4-hydroxy-3-methylbut-2-enyl diphosphate reductase NadA-like/4-hydroxy-3-methylbut-2-enyl diphosphate reductase NadA-like/4-hydroxy-3-methylbut-2-enyl diphosphate reductase	LigPlot