Ligand name: PYRIDOXAL-5'-PHOSPHATE
PDB ligand accession: PLP
DrugBank: DB00114
PubChem: 1051
ChEMBL: CHEMBL82202
InChI Key: NGVDGCNFYWLIFO-UHFFFAOYSA-N
SMILES: Cc1c(c(c(cn1)COP(=O)(O)O)C=O)O
Drug action: n/a

ClassyFire chemical classification:

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

List of PDB structures and/or AlphaFold models with target protein P0A6B4

PDB/AF Accession	PyMOL script	Experimental / Predicted	Interacting ECOD domains	ECOD X-group name	LigPlot
3B8U	Download	Experimental	e3b8uA1 e3b8uA2 e3b8uA1 e3b8uA2 e3b8uB1 e3b8uB2 e3b8uC1 e3b8uC2 e3b8uD2 e3b8uC1 e3b8uD1 e3b8uD2	cradle loop barrel TIM beta/alpha-barrel cradle loop barrel TIM beta/alpha-barrel cradle loop barrel TIM beta/alpha-barrel cradle loop barrel TIM beta/alpha-barrel cradle loop barrel cradle loop barrel TIM beta/alpha-barrel cradle loop barrel	LigPlot
2RJG	Download	Experimental	e2rjgA1 e2rjgA2 e2rjgB1 e2rjgA1 e2rjgA2 e2rjgB1 e2rjgB2 e2rjgC1 e2rjgC2 e2rjgD1 e2rjgC1 e2rjgD1 e2rjgD2	cradle loop barrel TIM beta/alpha-barrel cradle loop barrel cradle loop barrel TIM beta/alpha-barrel cradle loop barrel TIM beta/alpha-barrel cradle loop barrel TIM beta/alpha-barrel cradle loop barrel cradle loop barrel cradle loop barrel TIM beta/alpha-barrel	LigPlot
3B8V	Download	Experimental	e3b8vA1 e3b8vA2 e3b8vB1 e3b8vA1 e3b8vA2 e3b8vB1 e3b8vB2 e3b8vC1 e3b8vC2 e3b8vD1 e3b8vC1 e3b8vD1 e3b8vD2	cradle loop barrel TIM beta/alpha-barrel cradle loop barrel cradle loop barrel TIM beta/alpha-barrel cradle loop barrel TIM beta/alpha-barrel cradle loop barrel TIM beta/alpha-barrel cradle loop barrel cradle loop barrel cradle loop barrel TIM beta/alpha-barrel	LigPlot
3B8W	Download	Experimental	e3b8wA1 e3b8wA2 e3b8wB1 e3b8wA1 e3b8wA2 e3b8wB1 e3b8wB2 e3b8wC3 e3b8wC4 e3b8wD1 e3b8wC4 e3b8wD1 e3b8wD2	cradle loop barrel TIM beta/alpha-barrel cradle loop barrel cradle loop barrel TIM beta/alpha-barrel cradle loop barrel TIM beta/alpha-barrel TIM beta/alpha-barrel cradle loop barrel cradle loop barrel cradle loop barrel cradle loop barrel TIM beta/alpha-barrel	LigPlot
4WR3	Download	Experimental	e4wr3A1 e4wr3A2 e4wr3B1 e4wr3A1 e4wr3A2 e4wr3B1 e4wr3B2 e4wr3C1 e4wr3C2 e4wr3D2 e4wr3C2 e4wr3D1 e4wr3D2	TIM beta/alpha-barrel cradle loop barrel cradle loop barrel TIM beta/alpha-barrel cradle loop barrel cradle loop barrel TIM beta/alpha-barrel TIM beta/alpha-barrel cradle loop barrel cradle loop barrel cradle loop barrel TIM beta/alpha-barrel cradle loop barrel	LigPlot
3B8T	Download	Experimental	e3b8tA1 e3b8tA2 e3b8tB1 e3b8tA1 e3b8tA2 e3b8tB1 e3b8tB2 e3b8tC1 e3b8tC2 e3b8tD1 e3b8tC1 e3b8tD1 e3b8tD2	cradle loop barrel TIM beta/alpha-barrel cradle loop barrel cradle loop barrel TIM beta/alpha-barrel cradle loop barrel TIM beta/alpha-barrel cradle loop barrel TIM beta/alpha-barrel cradle loop barrel cradle loop barrel cradle loop barrel TIM beta/alpha-barrel	LigPlot