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Ligand · XJ1

XJ1 · (2E)-3-(3-{6-[(trans-4-aminocyclohexyl)amino]pyrazin-2-yl}phenyl)prop-2-enoic acid

XJ1, (2E)-3-(3-{6-[(trans-4-aminocyclohexyl)amino]pyrazin-2-yl}phenyl)prop-2-enoic acid (C19 H22 N4 O2, 338.4 g/mol), in the MolNFT structures on GenesisL1: bound in 2 records (1 PDB entry). Every binding site with its residues within 4.5…

Component
XJ1
Formula
C19 H22 N4 O2
Class
ligand
Structures
2
PDB entries
1

Binding sites

XJ1 in 2 structures; the first of them:

  • 2XJ1 · Protein kinase Pim-1 in complex with small molecule inibitor · XJ1 A1307 · binds LEU44, GLY45, SER46, PHE49, VAL52, ALA65, LYS67, GLU89 and 11 more
  • 2XJ1 · Protein kinase pim-1 in complex with small molecule inibitor · XJ1 A1307 · binds LEU44, GLY45, SER46, PHE49, VAL52, ALA65, LYS67, GLU89 and 11 more

Residues it binds most

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

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