Ligand · CS7

CS7 · N'-[(1S,2R)-2-[(2R,4R)-4-(benzyloxy)pyrrolidin-2-yl]-1-(3,5-difluorobenzyl)-2-hydroxyethyl]-5-methyl-N,N-dipropylisophthalamide

CS7, N'-[(1S,2R)-2-[(2R,4R)-4-(benzyloxy)pyrrolidin-2-yl]-1-(3,5-difluorobenzyl)-2-hydroxyethyl]-5-methyl-N,N-dipropylisophthalamide (C35 H43 F2 N3 O4, 607.7 g/mol), in the MolNFT structures on GenesisL1: bound in 2 records (1 PDB entry).…

Component: CS7
Formula: C35 H43 F2 N3 O4
Class: ligand
Structures: 2
PDB entries: 1

Binding sites

CS7 in 2 structures; the first of them:

2QMD · Structure of BACE Bound to SCH722924 · CS7 A1 · binds SER71, GLY72, GLN73, GLY74, LEU91, ASP93, GLY95, SER96 and 20 more
2QMD · Structure of bace bound to SCH722924 · CS7 A1 · binds SER71, GLY72, GLN73, GLY74, LEU91, ASP93, GLY95, SER96 and 20 more

Residues it binds most

GLY 4, ILE 4, THR 4, ARG 4, ASP 4, GLN 4, SER 4, TYR 4, LYS 4, LEU 4 (residue and the binding sites it lines).

Found with

TAR · D(-)-tartaric acid

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