Ligand · 595

595 · N-[(1S,5S)-5-{[(4-aminophenyl)sulfonyl](3-methylbutyl)amino}-1-methyl-6-oxohexyl]-Nalpha-(methoxycarbonyl)-beta-phenyl-L-phenylalaninamide

595, N-[(1S,5S)-5-{[(4-aminophenyl)sulfonyl](3-methylbutyl)amino}-1-methyl-6-oxohexyl]-Nalpha-(methoxycarbonyl)-beta-phenyl-L-phenylalaninamide (C35 H46 N4 O6 S, 650.8 g/mol), in the MolNFT structures on GenesisL1: bound in 2 records (1…

Component: 595
Formula: C35 H46 N4 O6 S
Class: ligand
Structures: 2
PDB entries: 1

Binding sites

595 in 2 structures; the first of them:

3M9F · HIV protease complexed with compound 10b · 595 A100 · binds LEU23, ASP25, GLY27, ALA28, ASP29, ASP30, VAL32, LYS45 and 22 more
3M9F · HIV protease complexed with compound 10B · 595 A100 · binds LEU23, ASP25, GLY27, ALA28, ASP29, ASP30, VAL32, LYS45 and 22 more

Residues it binds most

GLY 4, ASP 4, ILE 4, VAL 4, ALA 4, LEU 4, PRO 4, ARG 4, LYS 2, MET 2 (residue and the binding sites it lines).

Found with

CL · Chloride ion

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