Ligand · 526

526 · (3S)-tetrahydrofuran-3-yl {(2S,3R)-4-[(4S)-4-tert-butyl-7-fluoro-1,1-dioxido-4,5-dihydro-1,2-benzothiazepin-2(3H)-yl]-3-hydroxy-1-phenylbutan-2-yl}carbamate

526, (3S)-tetrahydrofuran-3-yl {(2S,3R)-4-[(4S)-4-tert-butyl-7-fluoro-1,1-dioxido-4,5-dihydro-1,2-benzothiazepin-2(3H)-yl]-3-hydroxy-1-phenylbutan-2-yl}carbamate (C28 H37 F N2 O6 S, 548.7 g/mol), in the MolNFT structures on GenesisL1…

Component: 526
Formula: C28 H37 F N2 O6 S
Class: ligand
Structures: 2
PDB entries: 1

Binding sites

526 in 2 structures; the first of them:

4MC1 · HIV protease in complex with SA526P · 526 A102 · binds ARG8, LEU23, ASP25, GLY27, ALA28, ASP29, ASP30, VAL32 and 22 more
4MC1 · HIV protease in complex with SA526P · 526 A102 · binds ARG8, LEU23, ASP25, GLY27, ALA28, ASP29, ASP30, VAL32 and 22 more

Residues it binds most

ASP 4, GLY 4, ILE 4, VAL 4, ALA 4, LEU 4, ARG 4, PRO 4 (residue and the binding sites it lines).

Found with

CL · Chloride ion

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