GL1X · GenesisL1 explorer

Ligand · C7J

C7J · (3R,3aS,4R,6aS)-4-chlorohexahydrofuro[2,3-b]furan-3-yl [(2S,3R)-4-{[(4-aminophenyl)sulfonyl](2-methylpropyl)amino}-3-hydroxy-1-phenylbutan-2-yl]carbamate

C7J, (3R,3aS,4R,6aS)-4-chlorohexahydrofuro[2,3-b]furan-3-yl [(2S,3R)-4-{[(4-aminophenyl)sulfonyl](2-methylpropyl)amino}-3-hydroxy-1-phenylbutan-2-yl]carbamate (C27 H36 Cl N3 O7 S, 582.1 g/mol), in the MolNFT structures on GenesisL1: bound…

Component
C7J
Formula
C27 H36 Cl N3 O7 S
Class
ligand
Structures
2
PDB entries
1

Binding sites

C7J in 2 structures; the first of them:

  • 5AH7 · Disubstituted bis-THF moieties as new P2 ligands in non-peptidal HIV- 1 Protease… · C7J A1101 · binds LEU23, ASP25, GLY27, ALA28, ASP29, ASP30, VAL32, ILE47 and 19 more
  • 5AH7 · Disubstituted bis-thf moieties as new P2 ligands in non-peptidal HIV- 1 protease… · C7J A1101 · binds LEU23, ASP25, GLY27, ALA28, ASP29, ASP30, VAL32, ILE47 and 19 more

Residues it binds most

ASP 2, GLY 2, ILE 2, VAL 2, ALA 2, LEU 2, THR 2, PRO 2 (residue and the binding sites it lines).

Found with

  • CL · Chloride ion

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