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Ligand · E8I

E8I · (2S)-2-[({4-[(2-amino-7H-pyrrolo[2,3-d]pyrimidin-4-yl) oxy]phenyl}carbamoyl)amino]-4-phenylbutanoic acid

E8I, (2S)-2-[({4-[(2-amino-7H-pyrrolo[2,3-d]pyrimidin-4-yl) oxy]phenyl}carbamoyl)amino]-4-phenylbutanoic acid (C23 H22 N6 O4, 446.5 g/mol), in the MolNFT structures on GenesisL1: bound in 2 records (1 PDB entry). Every binding site with…

Component
E8I
Formula
C23 H22 N6 O4
Class
ligand
Structures
2
PDB entries
1

Binding sites

E8I in 2 structures; the first of them:

  • 7T1T · JAK2 JH2 in complex with JAK292 · E8I A901 · binds LEU551, GLY554, THR555, ILE559, LEU579, LYS581, VAL610, GLN626 and 12 more
  • 7T1T · JAK2 JH2 in complex with JAK292 · E8I A901 · binds LEU551, GLY554, THR555, ILE559, LEU579, LYS581, VAL610, GLN626 and 12 more

Residues it binds most

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

Found with

  • GOL · Glycerol

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