GL1X · GenesisL1 explorer

Ligand · 0JV

0JV · methyl N-[(3S,3aR,5R,6aR)-5-[[(2S,3R)-4-[(4-methoxyphenyl)sulfonyl-(2-methylpropyl)amino]-3-oxidanyl-1-phenyl-butan-2-yl]carbamoyloxy]-3,3a,4,5,6,6a-hexahydro-2H-cyclopenta[b]furan-3-yl]carbamate

0JV, methyl N-[(3S,3aR,5R,6aR)-5-[[(2S,3R)-4-[(4-methoxyphenyl)sulfonyl-(2-methylpropyl)amino]-3-oxidanyl-1-phenyl-butan-2-yl]carbamoyloxy]-3,3a,4,5,6,6a-hexahydro-2H-cyclopenta[b]furan-3-yl]carbamate (C31 H43 N3 O9 S, 633.8 g/mol), in the…

Component
0JV
Formula
C31 H43 N3 O9 S
Class
ligand
Structures
2
PDB entries
1

Binding sites

0JV in 2 structures; the first of them:

  • 4DFG · Crystal Structure of Wild-type HIV-1 Protease with Cyclopentyltetrahydro- furanyl… · 0JV B201 · binds ARG8, LEU23, ASP25, GLY27, ALA28, ASP29, ASP30, VAL32 and 20 more
  • 4DFG · Crystal structure of wild-type HIV-1 protease with cyclopentyltetrahydro- furanyl… · 0JV B201 · binds ARG8, LEU23, ASP25, GLY27, ALA28, ASP29, ASP30, VAL32 and 20 more

Residues it binds most

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

Found with

  • NA · Sodium ion
  • CL · Chloride ion

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