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 Q9SIE1

PDB/AF Accession	PyMOL script	Experimental / Predicted	Interacting ECOD domains	ECOD X-group name	LigPlot
5WMH	Download	Experimental	e5wmhA1 e5wmhA2 e5wmhB1 e5wmhA1 e5wmhB1 e5wmhB2 e5wmhC1 e5wmhC2 e5wmhD1 e5wmhC2 e5wmhD1 e5wmhD2 e5wmhE1 e5wmhE2 e5wmhF2 e5wmhE2 e5wmhF2	PLP-dependent transferases C-terminal domain in some PLP-dependent transferases PLP-dependent transferases PLP-dependent transferases PLP-dependent transferases C-terminal domain in some PLP-dependent transferases C-terminal domain in some PLP-dependent transferases PLP-dependent transferases PLP-dependent transferases PLP-dependent transferases PLP-dependent transferases C-terminal domain in some PLP-dependent transferases C-terminal domain in some PLP-dependent transferases PLP-dependent transferases PLP-dependent transferases PLP-dependent transferases PLP-dependent transferases	LigPlot
6F5V	Download	Experimental	e6f5vB1 e6f5vA1 e6f5vA2 e6f5vB1 e6f5vB2 e6f5vA2 e6f5vC1 e6f5vC2 e6f5vD1 e6f5vC2 e6f5vD1 e6f5vD2	PLP-dependent transferases 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 C-terminal domain in some PLP-dependent transferases PLP-dependent transferases PLP-dependent transferases PLP-dependent transferases PLP-dependent transferases C-terminal domain in some PLP-dependent transferases	LigPlot