Ligand name: 3-hydroxy-N-[(2R,5R,6S,9S,10S,11R)-10-hydroxy-5,11-dimethyl-3,7,12-trioxo-2-(propan-2-yl)-9-(pyridin-3-ylmethyl)-1,4-dioxa-8-azacyclododecan-6-yl]pyridine-2-carboxamide
PDB ligand accession: I4I
DrugBank: n/a
PubChem: 71624761
ChEMBL: CHEMBL2323583
InChI Key: ZCNHOXIPSWXQHI-PMWBZGJESA-N
SMILES: CC1C(C(NC(=O)C(C(OC(=O)C(OC1=O)C(C)C)C)NC(=O)c2c(cccn2)O)Cc3cccnc3)O
Drug action: n/a

ClassyFire chemical classification:

• Kingdom: Organic compounds
  • Superclass: Organic acids and derivatives
    • Class: Peptidomimetics
      • Subclass: Depsipeptides

List of PDB structures and/or AlphaFold models with target protein P9WGR1

PDB/AF Accession	PyMOL script	Experimental / Predicted	Interacting ECOD domains	ECOD X-group name	LigPlot
4BGI	Download	Experimental	e4bgiA1 e4bgiB1 e4bgiF1	Rossmann-like Rossmann-like Rossmann-like	LigPlot