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Ligand · 0BG

0BG · N-{2-[methyl(7h-pyrrolo[2,3-d]pyrimidin-4-yl) amino]ethyl}-N~2~-phenylglycinamide

0BG, N-{2-[methyl(7h-pyrrolo[2,3-d]pyrimidin-4-yl) amino]ethyl}-N~2~-phenylglycinamide (C17 H20 N6 O, 324.4 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
0BG
Formula
C17 H20 N6 O
Class
ligand
Structures
2
PDB entries
1

Binding sites

0BG in 2 structures; the first of them:

  • 7N4R · Bruton's tyrosine kinase in complex with compound 21 · 0BG A701 · binds LEU408, PHE413, GLY414, VAL415, VAL416, ALA428, LYS430, MET431 and 11 more
  • 7N4R · BRUTON'S tyrosine kinase in complex with compound 21 · 0BG A701 · binds LEU408, PHE413, GLY414, VAL416, ALA428, LYS430, MET431, ILE472 and 7 more

Residues it binds most

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

Found with

  • DMS · Dimethyl sulfoxide

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