Ligand name: D-[3-HYDROXY-2-METHYL-5-PHOSPHONOOXYMETHYL-PYRIDIN-4-YLMETHYL]-N,O-CYCLOSERYLAMIDE
PDB ligand accession: DCS
DrugBank: DB02038
PubChem: 445005
ChEMBL: n/a
InChI Key: NNRZSZJOQKAGTO-SECBINFHSA-N
SMILES: Cc1c(c(c(cn1)COP(=O)(O)O)CNC2CONC2=O)O
Drug action: n/a

ClassyFire chemical classification:

• Kingdom: Organic compounds
  • Superclass: Organoheterocyclic compounds
    • Class: Pyridines and derivatives
      • Subclass: Pyridoxamines

List of PDB structures and/or AlphaFold models with target protein Q180W0

PDB/AF Accession	PyMOL script	Experimental / Predicted	Interacting ECOD domains	ECOD X-group name	LigPlot
4LUT	Download	Experimental	e4lutA1 e4lutA2 e4lutB2 e4lutA1 e4lutA2 e4lutB1 e4lutB2	TIM beta/alpha-barrel cradle loop barrel cradle loop barrel TIM beta/alpha-barrel cradle loop barrel TIM beta/alpha-barrel cradle loop barrel	LigPlot