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Ligand · WS9

WS9 · N-[(1E,3R)-5-amino-1-(1,3-oxazol-2-yl)-5-oxopent-1-en-3-yl]-1-{1-[4-(trifluoromethoxy)phenyl]cyclopropane-1-carbonyl}-L-prolinamide

WS9, N-[(1E,3R)-5-amino-1-(1,3-oxazol-2-yl)-5-oxopent-1-en-3-yl]-1-{1-[4-(trifluoromethoxy)phenyl]cyclopropane-1-carbonyl}-L-prolinamide (C24 H25 F3 N4 O5, 506.5 g/mol), in the MolNFT structures on GenesisL1: bound in 1 record (1 PDB…

Component
WS9
Formula
C24 H25 F3 N4 O5
Class
ligand
Structures
1
PDB entries
1

Binding sites

WS9 in 1 structure; the first of them:

  • 7FQK · Crystal Structure of human Legumain in complex with… · WS9 A502 · binds TYR41, ARG44, HIS45, SNN147, HIS148, GLY149, SER150, GLU187 and 11 more

Residues it binds most

TYR 4, SER 4, HIS 4, ALA 4, GLU 4, ARG 4, ASP 4, CYS 4, GLY 4, SNN 4 (residue and the binding sites it lines).

Found with

  • NAG · 2-acetamido-2-deoxy-beta-D-glucopyranose
  • EDO · 1,2-ethanediol
  • MES · 2-(N-morpholino)-ethanesulfonic acid

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