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Structure paper

TitleStructure-activity relationships, biological evaluation and structural studies of novel pyrrolonaphthoxazepines as antitumor agents.
Journal, issue, pagesEur J Med Chem, Vol. 162, Page 290-320, Year 2018
Publish dateMay 16, 2018 (structure data deposition date)
AuthorsBrindisi, M. / Ulivieri, C. / Alfano, G. / Gemma, S. / de Asis Balaguer, F. / Khan, T. / Grillo, A. / Chemi, G. / Menchon, G. / Prota, A.E. ...Brindisi, M. / Ulivieri, C. / Alfano, G. / Gemma, S. / de Asis Balaguer, F. / Khan, T. / Grillo, A. / Chemi, G. / Menchon, G. / Prota, A.E. / Olieric, N. / Lucena-Agell, D. / Barasoain, I. / Diaz, J.F. / Nebbioso, A. / Conte, M. / Lopresti, L. / Magnano, S. / Amet, R. / Kinsella, P. / Zisterer, D.M. / Ibrahim, O. / O'Sullivan, J. / Morbidelli, L. / Spaccapelo, R. / Baldari, C. / Butini, S. / Novellino, E. / Campiani, G. / Altucci, L. / Steinmetz, M.O. / Brogi, S.
External linksEur J Med Chem / PubMed:30448418
MethodsX-ray diffraction
Resolution2.4 Å
Structure data

PDB-6gj4:
Tubulin-6j complex
Method: X-RAY DIFFRACTION / Resolution: 2.4 Å

Chemicals

ChemComp-GTP:
GUANOSINE-5'-TRIPHOSPHATE / GTP, energy-carrying molecule*YM

ChemComp-MG:
Unknown entry

ChemComp-CA:
Unknown entry

ChemComp-GDP:
GUANOSINE-5'-DIPHOSPHATE / GDP, energy-carrying molecule*YM

ChemComp-EZW:
5-(quinolin-5-yl)naphtho[2,3-b]pyrrolo[1,2-d][1,4]oxazepin-4-yl acetate

ChemComp-MES:
2-(N-MORPHOLINO)-ETHANESULFONIC ACID / pH buffer*YM

ChemComp-ACP:
PHOSPHOMETHYLPHOSPHONIC ACID ADENYLATE ESTER / AMP-PCP, energy-carrying molecule analogue*YM

ChemComp-HOH:
WATER

Source
  • rattus norvegicus (Norway rat)
  • gallus gallus (chicken)
  • bos taurus (domestic cattle)
KeywordsCELL CYCLE / TUBULIN FOLD / CYTOSKELETON / MICROTUBULE

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