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Structure paper

TitleStructure-Activity Relationship Study of Novel 6-Aryl-2-benzoyl-pyridines as Tubulin Polymerization Inhibitors with Potent Antiproliferative Properties.
Journal, issue, pagesJ. Med. Chem., Vol. 63, Page 827-846, Year 2020
Publish dateAug 13, 2018 (structure data deposition date)
AuthorsChen, H. / Deng, S. / Wang, Y. / Albadari, N. / Kumar, G. / Ma, D. / Li, W. / White, S.W. / Miller, D.D.
External linksJ. Med. Chem. / PubMed:31860298
MethodsX-ray diffraction
Resolution2.602 - 2.8 Å
Structure data

PDB-6agk:
The structure of CH-II-77-tubulin complex
Method: X-RAY DIFFRACTION / Resolution: 2.8 Å

PDB-6pc4:
Tubulin-RB3_SLD-TTL in complex with compound ABI-274
Method: X-RAY DIFFRACTION / Resolution: 2.602 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-MES:
2-(N-MORPHOLINO)-ETHANESULFONIC ACID / pH buffer*YM

ChemComp-9WR:
[6-(3-hydroxy-4-methylphenyl)pyridin-2-yl](3,4,5-trimethoxyphenyl)methanone

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

ChemComp-HOH:
WATER

ChemComp-O91:
[2-(4-methylphenyl)-1H-imidazol-4-yl](3,4,5-trimethoxyphenyl)methanone

Source
  • sus scrofa (pig)
  • bos taurus (domestic cattle)
  • rattus norvegicus (Norway rat)
  • gallus gallus (chicken)
  • homo sapiens (human)
KeywordsSTRUCTURAL PROTEIN / TUBULIN / COMPLEX / INHIBITOR / CELL CYCLE / Microtubule Inhibitor / Colchicine / Cancer

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