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Ligand · M3A

M3A · 5-amino-3-[(4-cyanophenyl)amino]-N-phenyl-1H-1,2,4-triazole-1-carboxamide

M3A, 5-amino-3-[(4-cyanophenyl)amino]-N-phenyl-1H-1,2,4-triazole-1-carboxamide (C16 H13 N7 O, 319.3 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, the…

Component
M3A
Formula
C16 H13 N7 O
Class
ligand
Structures
2
PDB entries
1

Binding sites

M3A in 2 structures; the first of them:

  • 6OAV · JAK2 JH2 in complex with JAK146 · M3A A901 · binds LEU551, ILE559, LEU579, LYS581, VAL610, GLN626, GLU627, PHE628 and 9 more
  • 6OAV · JAK2 JH2 in complex with JAK146 · M3A A901 · binds LEU551, ILE559, LEU579, LYS581, GLN626, GLU627, PHE628, VAL629 and 6 more

Residues it binds most

LEU 2, LYS 2, PHE 2, SER 2, VAL 2, ASN 2, GLN 2, GLU 2, GLY 2, ILE 2 (residue and the binding sites it lines).

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