Ligand · 5E7

5E7 · N-[(2S,3R)-3-hydroxy-4-({(2S,3S)-3-hydroxy-1-[(2-methylpropyl)amino]-1-oxobutan-2-yl}amino)-1-phenylbutan-2-yl]-5-[methyl(methylsulfonyl)amino]-N'-[(1R)-1-phenylethyl]benzene-1,3-dicarboxamide

5E7, N-[(2S,3R)-3-hydroxy-4-({(2S,3S)-3-hydroxy-1-[(2-methylpropyl)amino]-1-oxobutan-2-yl}amino)-1-phenylbutan-2-yl]-5-[methyl(methylsulfonyl)amino]-N'-[(1R)-1-phenylethyl]benzene-1,3-dicarboxamide (C36 H49 N5 O7 S, 695.9 g/mol), in the…

Component: 5E7
Formula: C36 H49 N5 O7 S
Class: ligand
Structures: 2
PDB entries: 1

Binding sites

5E7 in 2 structures; the first of them:

5DQC · Co-crystal of BACE1 with compound 0211 · 5E7 A401 · binds GLY11, GLN12, GLY13, TYR14, LEU30, ASP32, GLY34, SER35 and 24 more
5DQC · Co-crystal of BACE1 with compound 0211 · 5E7 A401 · binds GLY11, GLN12, GLY13, TYR14, LEU30, ASP32, GLY34, SER35 and 24 more

Residues it binds most

GLY 6, ILE 6, THR 6, SER 6, TYR 6, ARG 6, ASP 6, GLN 6, VAL 6, ALA 6 (residue and the binding sites it lines).

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