Ligand · YUA
YUA · (3R,3aS,6aR)-hexahydrofuro[2,3-b]furan-3-yl [(2S,3R)-4-{(2-ethylbutyl)[(1S)-1-hydroxy-2,3-dihydro-1H-indene-5-sulfonyl]amino}-3-hydroxy-1-phenylbutan-2-yl]carbamate
YUA, (3R,3aS,6aR)-hexahydrofuro[2,3-b]furan-3-yl [(2S,3R)-4-{(2-ethylbutyl)[(1S)-1-hydroxy-2,3-dihydro-1H-indene-5-sulfonyl]amino}-3-hydroxy-1-phenylbutan-2-yl]carbamate (C32 H44 N2 O8 S, 616.8 g/mol), in the MolNFT structures on…
- Component
- YUA
- Formula
- C32 H44 N2 O8 S
- Class
- ligand
- Structures
- 4
- PDB entries
- 2
Binding sites
YUA in 4 structures; the first of them:
- 7M9U · HIV-1 Protease WT (NL4-3) in Complex with NR02-79 · YUA A101 · binds ARG8, LEU23, ASP25, GLY27, ALA28, ASP29, ASP30, VAL32 and 22 more
- 7M9X · HIV-1 Protease (I84V) in Complex with NR02-79 · YUA A101 · binds ARG8, LEU23, ASP25, GLY27, ALA28, ASP29, ASP30, VAL32 and 22 more
- 7M9U · HIV-1 protease wt (NL4-3) in complex with NR02-79 · YUA A101 · binds ARG8, ASP25, GLY27, ALA28, ASP29, ASP30, VAL32, ILE47 and 16 more
- 7M9X · HIV-1 protease (I84V) in complex with NR02-79 · YUA A101 · binds ARG8, ASP25, GLY27, ALA28, ASP29, ASP30, VAL32, ILE47 and 17 more
Residues it binds most
ASP 4, GLY 4, VAL 4, ILE 4, ALA 4, LEU 2, PRO 4, ARG 4, THR 4 (residue and the binding sites it lines).
Found with
- SO4 · Sulfate ion
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