Ligand name: CIS-HEME D HYDROXYCHLORIN GAMMA-SPIROLACTONE
PDB ligand accession: HDD
DrugBank: n/a
PubChem: n/a
ChEMBL: n/a
InChI Key: UMGOPAWIGKFTRK-QQDQPIDJSA-N
SMILES: Cc1c2n3c(c1CCC(=O)O)C=C4C5(CCC(=O)O5)C(C6=Cc7c(c(c8n7[Fe]3(N64)N9C(=C2)C(=C(C9=C8)C=C)C)C)C=C)(C)O
Drug action: n/a

ClassyFire chemical classification:

• Kingdom: Organic compounds
  • Superclass: Organoheterocyclic compounds
    • Class: Tetrapyrroles and derivatives
      • Subclass: Chlorins

List of PDB structures and/or AlphaFold models with target protein M4GGR5

PDB/AF Accession	PyMOL script	Experimental / Predicted	Interacting ECOD domains	ECOD X-group name	LigPlot
4B7A	Download	Experimental	e4b7aA2 e4b7aA3 e4b7aC5 e4b7aB1 e4b7aB2 e4b7aD2 e4b7aA2 e4b7aA3 e4b7aC1 e4b7aC5 e4b7aB2 e4b7aD1 e4b7aD2	Barrel domain in heme-dependent catalases First alpha-helical domain in heme-dependent catalases Barrel domain in heme-dependent catalases First alpha-helical domain in heme-dependent catalases Barrel domain in heme-dependent catalases Barrel domain in heme-dependent catalases Barrel domain in heme-dependent catalases First alpha-helical domain in heme-dependent catalases First alpha-helical domain in heme-dependent catalases Barrel domain in heme-dependent catalases Barrel domain in heme-dependent catalases First alpha-helical domain in heme-dependent catalases Barrel domain in heme-dependent catalases	LigPlot
4AUE	Download	Experimental	e4aueA2 e4aueA4 e4aueC1 e4aueB2 e4aueB4 e4aueD3 e4aueA2 e4aueA4 e4aueC1 e4aueC4 e4aueB4 e4aueD3 e4aueD4	First alpha-helical domain in heme-dependent catalases Barrel domain in heme-dependent catalases Barrel domain in heme-dependent catalases First alpha-helical domain in heme-dependent catalases Barrel domain in heme-dependent catalases Barrel domain in heme-dependent catalases First alpha-helical domain in heme-dependent catalases Barrel domain in heme-dependent catalases Barrel domain in heme-dependent catalases First alpha-helical domain in heme-dependent catalases Barrel domain in heme-dependent catalases Barrel domain in heme-dependent catalases First alpha-helical domain in heme-dependent catalases	LigPlot