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TitleDiscovery of a Novel Class of Triazolones as Checkpoint Kinase Inhibitors-Hit to Lead Exploration.
Journal, issue, pagesBioorg. Med. Chem., Vol. 20, Page 5133-, Year 2010
Publish dateMar 8, 2010 (structure data deposition date)
AuthorsOza, V. / Ashwell, S. / Brassil, P. / Breed, J. / Deng, C. / Ezhuthachan, J. / Haye, H. / Horn, C. / Janetka, J. / Lyne, P. ...Oza, V. / Ashwell, S. / Brassil, P. / Breed, J. / Deng, C. / Ezhuthachan, J. / Haye, H. / Horn, C. / Janetka, J. / Lyne, P. / Newcombe, N. / Otterbien, L. / Pass, M. / Read, J.A. / Roswell, S. / Su, M. / Toader, D. / Yu, D. / Yu, Y. / Valentine, A. / Webborn, P. / White, A. / Zabludoff, S. / Zheng, X.
External linksBioorg. Med. Chem. / PubMed:20673630
MethodsX-ray diffraction
Resolution1.9 - 2.5 Å
Structure data

PDB-2x8d:
Discovery of a Novel Class of triazolones as Checkpoint Kinase Inhibitors - Hit to Lead Exploration
Method: X-RAY DIFFRACTION / Resolution: 1.9 Å

PDB-2x8e:
Discovery of a Novel Class of triazolones as Checkpoint Kinase Inhibitors - Hit to Lead Exploration
Method: X-RAY DIFFRACTION / Resolution: 2.5 Å

PDB-2x8i:
Discovery of a Novel Class of triazolones as Checkpoint Kinase Inhibitors - Hit to Lead Exploration
Method: X-RAY DIFFRACTION / Resolution: 1.92 Å

Chemicals

ChemComp-X8D:
5-METHYL[1,2,4]TRIAZOLO[4,3-A]QUINOLIN-1(2H)-ONE

ChemComp-SO4:
SULFATE ION

ChemComp-HOH:
WATER

ChemComp-X8E:
5-METHYL-8-PYRIDIN-4-YL[1,2,4]TRIAZOLO[4,3-A]QUINOLIN-1(2H)-ONE

ChemComp-X8I:
7-(3-hydroxyphenyl)-5-methyl[1,2,4]triazolo[4,3-a]quinolin-1(2H)-one

ChemComp-GOL:
GLYCEROL

Source
  • homo sapiens (human)
KeywordsTRANSFERASE / NUCLEOTIDE-BINDING / CYTOSKELETON / PHOSPHOPROTEIN / ISOPEPTIDE BOND / CELL CYCLE / DNA DAMAGE / DNA REPAIR

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