Ligand name: benzyl [(1S,4S,7S,8R,9R,10S,13S,16S)-7,10-dibenzyl-8,9-dihydroxy-1,16-dimethyl-4,13-bis(1-methylethyl)-2,5,12,15,18-pentaoxo-20-phenyl-19-oxa-3,6,11,14,17-pentaazaicos-1-yl]carbamate
PDB ligand accession: 3TL
DrugBank: n/a
PubChem: 5481249
ChEMBL: CHEMBL449611
InChI Key: BJJPNOGMLLUCER-KUTQPOQPSA-N
SMILES: CC(C)C(C(=O)NC(Cc1ccccc1)C(C(C(Cc2ccccc2)NC(=O)C(C(C)C)NC(=O)C(C)NC(=O)OCc3ccccc3)O)O)NC(=O)C(C)NC(=O)OCc4ccccc4
Drug action: n/a

ClassyFire chemical classification:

• Kingdom: Organic compounds
  • Superclass: Organic acids and derivatives
    • Class: Carboxylic acids and derivatives
      • Subclass: Amino acids, peptides, and analogues

List of PDB structures and/or AlphaFold models with target protein Q903N5

PDB/AF Accession	PyMOL script	Experimental / Predicted	Interacting ECOD domains	ECOD X-group name	LigPlot
3KFS	Download	Experimental	e3kfsA1 e3kfsB1	cradle loop barrel cradle loop barrel	LigPlot
3KFN	Download	Experimental	e3kfnA1 e3kfnB1	cradle loop barrel cradle loop barrel	LigPlot
3KFR	Download	Experimental	e3kfrA1 e3kfrB1	cradle loop barrel cradle loop barrel	LigPlot
3KFP	Download	Experimental	e3kfpA1	cradle loop barrel	LigPlot
3KF0	Download	Experimental	e3kf0A1 e3kf0B1	cradle loop barrel cradle loop barrel	LigPlot