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Structure paper

TitleDiscovery of a Series of Novel 5H-Pyrrolo[2,3-B]Pyrazine-2-Phenyl Ethers, as Potent Jak3 Kinase Inhibitors.
Journal, issue, pagesBioorg. Med. Chem. Lett., Vol. 23, Page 2522-, Year 2013
Publish dateDec 6, 2012 (structure data deposition date)
AuthorsJaime-Figueroa, S. / De Vicente, J. / Hermann, J. / Jahangir, A. / Jin, S. / Kuglstatter, A. / Lynch, S.M. / Menke, J. / Niu, L. / Patel, V. ...Jaime-Figueroa, S. / De Vicente, J. / Hermann, J. / Jahangir, A. / Jin, S. / Kuglstatter, A. / Lynch, S.M. / Menke, J. / Niu, L. / Patel, V. / Shao, A. / Soth, M. / Vu, M.D. / Yee, C.
External linksBioorg. Med. Chem. Lett. / PubMed:23541670
MethodsX-ray diffraction
Resolution1.85 - 2.35 Å
Structure data

PDB-3zep:
Crystal Structure of JAK3 Kinase Domain in Complex with a Pyrrolopyrazine-2-phenyl Ether Inhibitor
Method: X-RAY DIFFRACTION / Resolution: 2.35 Å

PDB-4i6q:
JAK3 kinase domain in complex with 2-Phenoxy-5H-pyrrolo[2,3-b]pyrazine-7-carboxylic acid ((S)-1-cyclopropyl-ethyl)-amide
Method: X-RAY DIFFRACTION / Resolution: 1.85 Å

Chemicals

ChemComp-1NX:
2-[[(3R)-3-acetamido-2,3-dihydro-1H-inden-5-yl]oxy]-N-[(1S)-1-cyclopropylethyl]-5H-pyrrolo[2,3-b]pyrazine-7-carboxamide

ChemComp-GOL:
GLYCEROL

ChemComp-HOH:
WATER

ChemComp-PHU:
1-phenylurea

ChemComp-1DT:
N-[(1S)-1-cyclopropylethyl]-2-phenoxy-5H-pyrrolo[2,3-b]pyrazine-7-carboxamide

Source
  • homo sapiens (human)
KeywordsTRANSFERASE / STAT5 / STAT6 / INTERLEUKIN-2 / COMMON-GAMMA CHAIN / ATP SITE KINASE INHIBITOR / CANCER / SCID / SEVERE COMBINED IMMUNODEFICIENCY / Transferase/Transferase Inhibitor / Kinase-Inhibitor Complex / Transferase-Transferase Inhibitor complex

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