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Ligand · I39

I39 · [3-amino-2-(2-methylphenyl)-1-oxidopyridin-4-yl](2,4-difluorophenyl)methanone

I39, [3-amino-2-(2-methylphenyl)-1-oxidopyridin-4-yl](2,4-difluorophenyl)methanone (C19 H14 F2 N2 O2, 340.3 g/mol), in the MolNFT structures on GenesisL1: bound in 2 records (1 PDB entry). Every binding site with its residues within 4.5 Å…

Component
I39
Formula
C19 H14 F2 N2 O2
Class
ligand
Structures
2
PDB entries
1

Binding sites

I39 in 2 structures; the first of them:

  • 3HRB · p38 kinase Crystal structure in complex with small molecule inhibitor · I39 A1 · binds VAL30, VAL38, ALA51, VAL52, LYS53, LEU75, ILE84, LEU86 and 11 more
  • 3HRB · P38 kinase crystal structure in complex with small molecule inhibitor · I39 A1 · binds VAL30, VAL38, ALA51, VAL52, LYS53, LEU75, ILE84, LEU86 and 11 more

Residues it binds most

LEU 2, VAL 2, ALA 2, ASP 2, GLY 2, HIS 2, ILE 2, LYS 2, MET 2, THR 2 (residue and the binding sites it lines).

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