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Ligand · 0F0

0F0 · 3-{[4-(dimethylamino)butanoyl]amino}-N-(4-{[4-(pyridin-3-yl)pyrimidin-2-yl]amino}phenyl)benzamide

0F0, 3-{[4-(dimethylamino)butanoyl]amino}-N-(4-{[4-(pyridin-3-yl)pyrimidin-2-yl]amino}phenyl)benzamide (C28 H29 N7 O2, 495.6 g/mol), in the MolNFT structures on GenesisL1: bound in 2 records (1 PDB entry). Every binding site with its…

Component
0F0
Formula
C28 H29 N7 O2
Class
ligand
Structures
2
PDB entries
1

Binding sites

0F0 in 2 structures; the first of them:

  • 3V6S · Discovery of potent and selective covalent inhibitors of JNK · 0F0 A501 · binds ILE70, GLY71, SER72, GLN75, GLY76, VAL78, ALA91, LYS93 and 17 more
  • 3V6S · Discovery of potent and selective covalent inhibitors of jnk · 0F0 A501 · binds ILE70, GLY71, SER72, GLN75, GLY76, VAL78, ALA91, LYS93 and 17 more

Residues it binds most

ILE 4, GLN 4, ALA 4, GLU 4, LEU 4, MET 4, VAL 4, ASN 4, ASP 4, CYS 4 (residue and the binding sites it lines).

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