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Ligand · 52U

52U · (3aS,4S,7aR)-hexahydro-4H-furo[2,3-b]pyran-4-yl [(2S,3R)-3-hydroxy-4-{[(4-methoxyphenyl)sulfonyl](2-methylpropyl)amino}-1-phenylbutan-2-yl]carbamate

52U, (3aS,4S,7aR)-hexahydro-4H-furo[2,3-b]pyran-4-yl [(2S,3R)-3-hydroxy-4-{[(4-methoxyphenyl)sulfonyl](2-methylpropyl)amino}-1-phenylbutan-2-yl]carbamate (C29 H40 N2 O8 S, 576.7 g/mol), in the MolNFT structures on GenesisL1: bound in 2…

Component
52U
Formula
C29 H40 N2 O8 S
Class
ligand
Structures
2
PDB entries
1

Binding sites

52U in 2 structures; the first of them:

  • 5COK · X-ray crystal structure of wild type HIV-1 protease in complex with GRL-0476 · 52U A400 · binds ARG8, LEU23, ASN25, GLY27, ALA28, ASP29, ASP30, VAL32 and 22 more
  • 5COK · X-ray crystal structure of wild type HIV-1 protease in complex with grl-0476 · 52U A400 · binds ARG8, LEU23, ASN25, GLY27, ALA28, ASP29, ASP30, VAL32 and 22 more

Residues it binds most

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

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