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Title | Development, Optimization, and Structure-Activity Relationships of Covalent-Reversible JAK3 Inhibitors Based on a Tricyclic Imidazo[5,4- d]pyrrolo[2,3- b]pyridine Scaffold. |
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Journal, issue, pages | J. Med. Chem., Vol. 61, Page 5350-5366, Year 2018 |
Publish date | May 23, 2018 (structure data deposition date) |
Authors | Forster, M. / Chaikuad, A. / Dimitrov, T. / Doring, E. / Holstein, J. / Berger, B.T. / Gehringer, M. / Ghoreschi, K. / Muller, S. / Knapp, S. / Laufer, S.A. |
External links | J. Med. Chem. / PubMed:29852068 |
Methods | X-ray diffraction |
Resolution | 1.7 - 2 Å |
Structure data | PDB-6gl9: PDB-6gla: PDB-6glb: |
Chemicals | ChemComp-F3W: ChemComp-PHU: ChemComp-GOL: ChemComp-EDO: ChemComp-HOH: ChemComp-F4B: ChemComp-F48: |
Source |
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Keywords | TRANSFERASE / KINASE / JAK3 / COVALENT INHIBITOR / REVERSIBLE COVALENT INHIBITOR / INDUCED POCKET / ARGININE POCKET / STRUCTURAL GENOMICS CONSORTIUM / SGC |