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Ligand · DKJ

DKJ · N-{(1S,2S)-3-(3,5-difluorophenyl)-1-[(3R,5S,6R)-6-(2,2-dimethylpropoxy)-5-methylmorpholin-3-yl]-1-hydroxypropan-2-yl}acetamide

DKJ, N-{(1S,2S)-3-(3,5-difluorophenyl)-1-[(3R,5S,6R)-6-(2,2-dimethylpropoxy)-5-methylmorpholin-3-yl]-1-hydroxypropan-2-yl}acetamide (C21 H32 F2 N2 O4, 414.5 g/mol), in the MolNFT structures on GenesisL1: bound in 1 record (1 PDB entry).…

Component
DKJ
Formula
C21 H32 F2 N2 O4
Class
ligand
Structures
1
PDB entries
1

Binding sites

DKJ in 1 structure; the first of them:

  • 6BFX · Bace crystal structure with hydroxy pyrrolidine inhibitor · DKJ A401 · binds LEU30, ASP32, GLY34, SER35, VAL69, PRO70, TYR71, THR72 and 11 more

Residues it binds most

ILE 2, GLY 2, ASP 2, THR 2, TYR 2, LEU 2, PHE 2, PRO 2, SER 2, TRP 2 (residue and the binding sites it lines).

Found with

  • GOL · Glycerol

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