GL1X · GenesisL1 explorer

Ligand · VXL

VXL · (3R,3aS,4R,6aR)-4-[2-(methylamino)-2-oxoethoxy]hexahydrofuro[2,3-b]furan-3-yl [(2S,3R)-3-hydroxy-4-{[(4-methoxyphenyl)sulfonyl](2-methylpropyl)amino}-1-phenylbutan-2-yl]carbamate

VXL, (3R,3aS,4R,6aR)-4-[2-(methylamino)-2-oxoethoxy]hexahydrofuro[2,3-b]furan-3-yl [(2S,3R)-3-hydroxy-4-{[(4-methoxyphenyl)sulfonyl](2-methylpropyl)amino}-1-phenylbutan-2-yl]carbamate (C31 H43 N3 O10 S, 649.8 g/mol), in the MolNFT…

Component
VXL
Formula
C31 H43 N3 O10 S
Class
ligand
Structures
2
PDB entries
1

Binding sites

VXL in 2 structures; the first of them:

  • 5AHC · Disubstituted bis-THF moieties as new P2 ligands in non-peptidal HIV- 1 Protease… · VXL A1101 · binds LEU23, ASP25, GLY27, ALA28, ASP29, ASP30, VAL32, GLY48 and 18 more
  • 5AHC · Disubstituted bis-thf moieties as new P2 ligands in non-peptidal HIV- 1 protease… · VXL A1101 · binds LEU23, ASP25, GLY27, ALA28, ASP29, ASP30, VAL32, GLY48 and 18 more

Residues it binds most

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

Found with

  • CL · Chloride ion

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