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Structure paper

TitleDesign, Synthesis, and Cytotoxic Evaluation of Novel Tubulysin Analogues as ADC Payloads.
Journal, issue, pagesACS Med Chem Lett, Vol. 7, Page 999-1004, Year 2016
Publish dateJul 20, 2016 (structure data deposition date)
AuthorsLeverett, C.A. / Sukuru, S.C. / Vetelino, B.C. / Musto, S. / Parris, K. / Pandit, J. / Loganzo, F. / Varghese, A.H. / Bai, G. / Liu, B. ...Leverett, C.A. / Sukuru, S.C. / Vetelino, B.C. / Musto, S. / Parris, K. / Pandit, J. / Loganzo, F. / Varghese, A.H. / Bai, G. / Liu, B. / Liu, D. / Hudson, S. / Doppalapudi, V.R. / Stock, J. / O'Donnell, C.J. / Subramanyam, C.
External linksACS Med Chem Lett / PubMed:27882198
MethodsX-ray diffraction
Resolution2.5 Å
Structure data

PDB-5kx5:
Crystal structure of tubulin-stathmin-TTL-Compound 11 complex
Method: X-RAY DIFFRACTION / Resolution: 2.5 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-6YK:
(2~{S},4~{R})-4-[[2-[(1~{R},3~{R})-1-acetyloxy-3-[[(2~{S},3~{S})-2-[[(2~{R})-1,2-dimethylpyrrolidin-2-yl]carbonylamino]-3-methyl-pentanoyl]-methyl-amino]-4-methyl-pentyl]-1,3-thiazol-4-yl]carbonylamino]-5-(4-aminophenyl)-2-methyl-pentanoic acid

ChemComp-ADP:
ADENOSINE-5'-DIPHOSPHATE / ADP, energy-carrying molecule*YM

ChemComp-HOH:
WATER

Source
  • rattus norvegicus (Norway rat)
  • gallus gallus (chicken)
  • ovis aries (sheep)
KeywordsSTRUCTURAL PROTEIN/INHIBITOR / Tubulin Tubulysin / STRUCTURAL PROTEIN-INHIBITOR complex

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