Ligand name: PYRROLOQUINOLINE QUINONE
PDB ligand accession: PQQ
DrugBank: DB03205
PubChem: 1024
ChEMBL: CHEMBL1235421
InChI Key: MMXZSJMASHPLLR-UHFFFAOYSA-N
SMILES: c1c2c([nH]c1C(=O)O)-c3c(cc(nc3C(=O)C2=O)C(=O)O)C(=O)O
Drug action: n/a

ClassyFire chemical classification:

• Kingdom: Organic compounds
  • Superclass: Organoheterocyclic compounds
    • Class: Quinolines and derivatives
      • Subclass: Pyrroloquinolines

List of PDB structures and/or AlphaFold models with target protein A6T9H1

PDB/AF Accession	PyMOL script	Experimental / Predicted	Interacting ECOD domains	ECOD X-group name	LigPlot
3HML	Download	Experimental	e3hmlA1 e3hmlB1	Ferritin/Heme oxygenase/4-helical cytokines Ferritin/Heme oxygenase/4-helical cytokines	LigPlot
4NY7	Download	Experimental	e4ny7A1 e4ny7B1	Ferritin/Heme oxygenase/4-helical cytokines Ferritin/Heme oxygenase/4-helical cytokines	LigPlot
3HLX	Download	Experimental	e3hlxA1 e3hlxD1	Ferritin/Heme oxygenase/4-helical cytokines Ferritin/Heme oxygenase/4-helical cytokines	LigPlot