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Ligand · LGJ

LGJ · N-(3-fluoro-2'-(methylsulfonyl)biphenyl-4-yl)-1-(3-(5-oxo-4,5-dihydro-1H-1,2,4-triazol-3-yl)phenyl)-3-(trifluoromethyl)-1H-pyrazole-5-carboxamide

LGJ, N-(3-fluoro-2'-(methylsulfonyl)biphenyl-4-yl)-1-(3-(5-oxo-4,5-dihydro-1H-1,2,4-triazol-3-yl)phenyl)-3-(trifluoromethyl)-1H-pyrazole-5-carboxamide (C26 H18 F4 N6 O4 S, 586.5 g/mol), in the MolNFT structures on GenesisL1: bound in 2…

Component
LGJ
Formula
C26 H18 F4 N6 O4 S
Class
ligand
Structures
2
PDB entries
1

Binding sites

LGJ in 2 structures; the first of them:

  • 3KQB · Factor xa in complex with the inhibitor n-(3-fluoro-2'… · LGJ A301 · binds LYS96, GLU97, THR98, TYR99, ARG143, GLU146, PHE174, ASP189 and 14 more
  • 3KQB · Factor xa in complex with the inhibitor N-(3-fluoro-2'… · LGJ A301 · binds LYS96, GLU97, THR98, TYR99, ARG143, GLU146, PHE174, ASP189 and 14 more

Residues it binds most

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

Found with

  • NA · Sodium ion

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