Ligand name: (2~{S})-2-[[2-methyl-3-oxidanyl-5-(phosphonooxymethyl)pyridin-4-yl]methylamino]-4-sulfanyl-butanoic acid
PDB ligand accession: 7XF
DrugBank: n/a
PubChem: 126476629
ChEMBL: n/a
InChI Key: PXCMMZUTCUCUSM-JTQLQIEISA-N
SMILES: Cc1c(c(c(cn1)COP(=O)(O)O)CNC(CCS)C(=O)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 P13254

PDB/AF Accession	PyMOL script	Experimental / Predicted	Interacting ECOD domains	ECOD X-group name	LigPlot
7F1V	Download	Experimental	e7f1vA1 e7f1vA2 e7f1vB2 e7f1vC1 e7f1vC2 e7f1vD2	C-terminal domain in some PLP-dependent transferases PLP-dependent transferases PLP-dependent transferases C-terminal domain in some PLP-dependent transferases PLP-dependent transferases PLP-dependent transferases	LigPlot
5X30	Download	Experimental	e5x30C1 e5x30D1 e5x30D2	PLP-dependent transferases C-terminal domain in some PLP-dependent transferases PLP-dependent transferases	LigPlot