Ligand name: ~{N}-[(5~{S},7~{R},11~{S},23~{S})-11-~{tert}-butyl-34-(4-methyl-1,3-thiazol-5-yl)-7-oxidanyl-4,10,13-tris(oxidanylidene)-15,18,21,25,28,31-hexaoxa-3,9,12-triazatricyclo[30.4.0.0^{5,9}]hexatriaconta-1(32),33,35-trien-23-yl]-2-[(7~{S},9~{S})-7-(4-chlorophenyl)-4,5,13-trimethyl-3-thia-1,8,11,12-tetrazatricyclo[8.3.0.0^{2,6}]trideca-2(6),4,10,12-tetraen-9-yl]ethanamide
PDB ligand accession: LFE
DrugBank: n/a
PubChem: 145946067
ChEMBL: n/a
InChI Key: VFKKFUVFBVEDJY-NXSSZGKESA-N
SMILES: Cc1c(sc-2c1C(NC(c3n2c(nn3)C)CC(=O)NC4COCCOCCOCC(=O)NC(C(=O)N5CC(CC5C(=O)NCc6ccc(cc6OCCOCCOC4)c7c(ncs7)C)O)C(C)(C)C)c8ccc(cc8)Cl)C
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 P40337

PDB/AF Accession	PyMOL script	Experimental / Predicted	Interacting ECOD domains	ECOD X-group name	LigPlot
6SIS	Download	Experimental	e6sisA1 e6sisD1 e6sisE1 e6sisH2	Bromodomain-like Immunoglobulin-like beta-sandwich Bromodomain-like Immunoglobulin-like beta-sandwich	LigPlot