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Ligand · 48U

48U · 4-[(3S)-3-({[(E)-2-(5-chlorothiophen-2-yl)ethenyl]sulfonyl}amino)-2-oxopyrrolidin-1-yl]-3-fluoro-N,N-dimethylbenzamide

48U, 4-[(3S)-3-({[(E)-2-(5-chlorothiophen-2-yl)ethenyl]sulfonyl}amino)-2-oxopyrrolidin-1-yl]-3-fluoro-N,N-dimethylbenzamide (C19 H19 Cl F N3 O4 S2, 471.9 g/mol), in the MolNFT structures on GenesisL1: bound in 2 records (1 PDB entry).…

Component
48U
Formula
C19 H19 Cl F N3 O4 S2
Class
ligand
Structures
2
PDB entries
1

Binding sites

48U in 2 structures; the first of them:

  • 4Y6D · Factor Xa complex with GTC000101 · 48U A301 · binds LYS96, GLU97, THR98, TYR99, PHE174, ASP189, ALA190, CYS191 and 11 more
  • 4Y6D · Factor xa complex with GTC000101 · 48U A301 · binds LYS96, GLU97, THR98, TYR99, PHE174, ASP189, ALA190, CYS191 and 11 more

Residues it binds most

GLY 2, CYS 2, GLU 2, TYR 2, ALA 2, ASP 2, GLN 2, ILE 2, LYS 2, PHE 2 (residue and the binding sites it lines).

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