Ligand name: 3-[4-(2-hydroxy-2-oxoethyl)-5-[[4-(2-hydroxy-2-oxoethyl)-5-[[4-(2-hydroxy-2-oxoethyl)-5-[[4-(2-hydroxy-2-oxoethyl)-3-(3-hydroxy-3-oxopropyl)-5-methyl-1~{H}-pyrrol-2-yl]methyl]-3-(3-hydroxy-3-oxopropyl)-1~{H}-pyrrol-2-yl]methyl]-3-(3-hydroxy-3-oxopropyl)-1~{H}-pyrrol-2-yl]methyl]-1~{H}-pyrrol-3-yl]propanoic acid
PDB ligand accession: 7J8
DrugBank: n/a
PubChem: 137348625
ChEMBL: n/a
InChI Key: VHZWMEJYGVBAFI-UHFFFAOYSA-N
SMILES: Cc1c(c(c([nH]1)Cc2c(c(c([nH]2)Cc3c(c(c([nH]3)Cc4c(c(c[nH]4)CCC(=O)O)CC(=O)O)CCC(=O)O)CC(=O)O)CCC(=O)O)CC(=O)O)CCC(=O)O)CC(=O)O
Drug action: n/a

ClassyFire chemical classification:

• Kingdom: Organic compounds
  • Superclass: Organoheterocyclic compounds
    • Class: Tetrapyrroles and derivatives
      • Subclass: None

List of PDB structures and/or AlphaFold models with target protein P08397

PDB/AF Accession	PyMOL script	Experimental / Predicted	Interacting ECOD domains	ECOD X-group name	LigPlot
7AAK	Download	Experimental	e7aakA1 e7aakA2 e7aakA3 e7aakB1 e7aakB2 e7aakB3	dsRBD-like Periplasmic binding protein-like II Periplasmic binding protein-like II dsRBD-like Periplasmic binding protein-like II Periplasmic binding protein-like II	LigPlot
7CCZ	Download	Experimental	e7cczA1 e7cczA2 e7cczA3 e7cczB1 e7cczB2 e7cczB3	dsRBD-like Periplasmic binding protein-like II Periplasmic binding protein-like II Periplasmic binding protein-like II Periplasmic binding protein-like II dsRBD-like	LigPlot
5M6R	Download	Experimental	e5m6rA1 e5m6rA2 e5m6rA3 e5m6rB1 e5m6rB2 e5m6rB3	dsRBD-like Periplasmic binding protein-like II Periplasmic binding protein-like II Periplasmic binding protein-like II Periplasmic binding protein-like II dsRBD-like	LigPlot
7CD0	Download	Experimental	e7cd0A1 e7cd0A2 e7cd0A3 e7cd0B1 e7cd0B2 e7cd0B3	dsRBD-like Periplasmic binding protein-like II Periplasmic binding protein-like II dsRBD-like Periplasmic binding protein-like II Periplasmic binding protein-like II	LigPlot