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Ligand · 49W

49W · N'-[(2S,3S)-3-hydroxy-1-phenyl-4-{[2-(pyridin-2-yl)propan-2-yl]amino}butan-2-yl]-N,N-dipropyl-5-(pyridin-1(2H)-yl)benzene-1,3-dicarboxamide

49W, N'-[(2S,3S)-3-hydroxy-1-phenyl-4-{[2-(pyridin-2-yl)propan-2-yl]amino}butan-2-yl]-N,N-dipropyl-5-(pyridin-1(2H)-yl)benzene-1,3-dicarboxamide (C37 H47 N5 O3, 609.8 g/mol), in the MolNFT structures on GenesisL1: bound in 2 records (1 PDB…

Component
49W
Formula
C37 H47 N5 O3
Class
ligand
Structures
2
PDB entries
1

Binding sites

49W in 2 structures; the first of them:

  • 4YA8 · structure of plasmepsin II from Plasmodium Falciparum complexed with inhibitor PG394 · 49W A400 · binds ILE14, MET15, ILE32, ASP34, GLY36, SER37, TYR77, VAL78 and 15 more
  • 4YA8 · Structure of plasmepsin II from plasmodium falciparum complexed with inhibitor PG394 · 49W A400 · binds ILE14, MET15, ILE32, ASP34, GLY36, SER37, TYR77, VAL78 and 15 more

Residues it binds most

ILE 8, SER 8, THR 8, ASP 8, GLY 8, PHE 8, TYR 8, LEU 8, MET 8, VAL 8 (residue and the binding sites it lines).

Found with

  • GOL · Glycerol

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