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Ligand · 0UJ

0UJ · N-({1-[(1R,2R,4S)-bicyclo[2.2.1]hept-2-yl]-1,6-dihydroimidazo[4,5-d]pyrrolo[2,3-b]pyridin-2-yl}methyl)methanesulfonamide

0UJ, N-({1-[(1R,2R,4S)-bicyclo[2.2.1]hept-2-yl]-1,6-dihydroimidazo[4,5-d]pyrrolo[2,3-b]pyridin-2-yl}methyl)methanesulfonamide (C17 H21 N5 O2 S, 359.4 g/mol), in the MolNFT structures on GenesisL1: bound in 2 records (1 PDB entry). Every…

Component
0UJ
Formula
C17 H21 N5 O2 S
Class
ligand
Structures
2
PDB entries
1

Binding sites

0UJ in 2 structures; the first of them:

  • 4FK6 · JAK1 kinase (JH1 domain) in complex with compound 72 · 0UJ A1201 · binds ARG879, ASP880, LEU881, GLY882, VAL889, ALA906, VAL938, MET956 and 11 more
  • 4FK6 · JAK1 kinase (JH1 domain) in complex with compound 72 · 0UJ A1201 · binds ARG879, ASP880, LEU881, GLY882, VAL889, ALA906, VAL938, MET956 and 11 more

Residues it binds most

GLY 4, LEU 4, ARG 4, ASP 4, GLU 4, VAL 4, ALA 4, ASN 4, MET 4, PHE 4 (residue and the binding sites it lines).

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