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Structure paper

TitleSar and Inhibitor Complex Structure Determination of a Novel Class of Potent and Specific Aurora Kinase Inhibitors.
Journal, issue, pagesBioorg. Med. Chem. Lett., Vol. 16, Page 1320-, Year 2006
Publish dateNov 9, 2005 (structure data deposition date)
AuthorsHeron, N.M. / Anderson, M. / Blowers, D.P. / Breed, J. / Eden, J.M. / Green, S. / Hill, G.B. / Johnson, T. / Jung, F.H. / Mcmiken, H.H.J. ...Heron, N.M. / Anderson, M. / Blowers, D.P. / Breed, J. / Eden, J.M. / Green, S. / Hill, G.B. / Johnson, T. / Jung, F.H. / Mcmiken, H.H.J. / Mortlock, A.A. / Pannifer, A.D. / Pauptit, R.A. / Pink, J. / Roberts, N.J. / Rowsell, S.
External linksBioorg. Med. Chem. Lett. / PubMed:16337122
MethodsX-ray diffraction
Resolution2.1 - 2.2 Å
Structure data

PDB-2c6d:
Aurora A kinase activated mutant (T287D) in complex with ADPNP
Method: X-RAY DIFFRACTION / Resolution: 2.2 Å

PDB-2c6e:
Aurora A kinase activated mutant (T287D) in complex with a 5- aminopyrimidinyl quinazoline inhibitor
Method: X-RAY DIFFRACTION / Resolution: 2.1 Å

Chemicals

ChemComp-GOL:
GLYCEROL

ChemComp-PO4:
PHOSPHATE ION

ChemComp-ANP:
PHOSPHOAMINOPHOSPHONIC ACID-ADENYLATE ESTER / AMP-PNP, energy-carrying molecule analogue*YM

ChemComp-HOH:
WATER

ChemComp-HPM:
N-{5-[(7-{[(2S)-2-HYDROXY-3-PIPERIDIN-1-YLPROPYL]OXY}-6-METHOXYQUINAZOLIN-4-YL)AMINO]PYRIMIDIN-2-YL}BENZAMIDE

Source
  • homo sapiens (human)
KeywordsTRANSFERASE / AURORA / KINASE / MITOSIS / CANCER / CELL CYCLE / SERINE/THREONINE-PROTEIN KINASE / ATP-BINDING / PHOSPHORYLATION / NUCLEOTIDE-BINDING / TRANSFERASE/INHIBITOR / TRANSFERASE-INHIBITOR COMPLEX / NUCLEOTIDE- BINDING

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