Literature DB >> 19414254

Structural insight into human CK2alpha in complex with the potent inhibitor ellagic acid.

Yusuke Sekiguchi1, Tetsuko Nakaniwa, Takayoshi Kinoshita, Isao Nakanishi, Kazuo Kitaura, Akira Hirasawa, Gozoh Tsujimoto, Toshiji Tada.   

Abstract

We determined the 2.35-A crystal structure of a human CK2 catalytic subunit (referred to as CK2alpha complexed with the ATP-competitive, potent CK2 inhibitor ellagic acid. The inhibitor binds to CK2alpha with a novel binding mode, including water-mediated hydrogen bonds. This structural information may support discovery of potent CK2 inhibitors.

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Year:  2009        PMID： 19414254     DOI： 10.1016/j.bmcl.2009.04.076

Source DB:  PubMed          Journal:  Bioorg Med Chem Lett        ISSN： 0960-894X            Impact factor:   2.823


  11 in total

1.  Coupling Supervised Molecular Dynamics (SuMD) with Entropy Estimations To Shine Light on the Stability of Multiple Binding Sites.

Authors:  Shailesh Kumar Panday; Mattia Sturlese; Veronica Salmaso; Indira Ghosh; Stefano Moro
Journal:  ACS Med Chem Lett       Date:  2019-02-15       Impact factor: 4.345

2.  A detailed thermodynamic profile of cyclopentyl and isopropyl derivatives binding to CK2 kinase.

Authors:  Takayoshi Kinoshita; Yusuke Sekiguchi; Harumi Fukada; Tetsuko Nakaniwa; Toshiji Tada; Shinya Nakamura; Kazuo Kitaura; Hiroaki Ohno; Yamato Suzuki; Akira Hirasawa; Isao Nakanishi; Gozoh Tsujimoto
Journal:  Mol Cell Biochem       Date:  2011-07-07       Impact factor: 3.396

3.  Effects of fruit ellagitannin extracts, ellagic acid, and their colonic metabolite, urolithin A, on Wnt signaling.

Authors:  Meenakshi Sharma; Liya Li; Jeremy Celver; Caroline Killian; Abraham Kovoor; Navindra P Seeram
Journal:  J Agric Food Chem       Date:  2010-04-14       Impact factor: 5.279

4.  Inhibitory effect of a standardized pomegranate fruit extract on Wnt signalling in 1, 2-dimethylhydrazine induced rat colon carcinogenesis.

Authors:  Nermin Abdel Hamid Sadik; Olfat Gamil Shaker
Journal:  Dig Dis Sci       Date:  2013-05-31       Impact factor: 3.199

5.  Ellagic acid, a phenolic compound, exerts anti-angiogenesis effects via VEGFR-2 signaling pathway in breast cancer.

Authors:  Neng Wang; Zhi-Yu Wang; Sui-Lin Mo; Tjing Yung Loo; Dong-Mei Wang; Hai-Bin Luo; De-Po Yang; Yu-Ling Chen; Jian-Gang Shen; Jian-Ping Chen
Journal:  Breast Cancer Res Treat       Date:  2012-02-21       Impact factor: 4.872

6.  Crystal structure of human CK2α at 1.06 Å resolution.

Authors:  Takayoshi Kinoshita; Tetsuko Nakaniwa; Yusuke Sekiguchi; Yuri Sogabe; Atsushi Sakurai; Shinya Nakamura; Isao Nakanishi
Journal:  J Synchrotron Radiat       Date:  2013-10-02       Impact factor: 2.616

Review 7.  The Development of CK2 Inhibitors: From Traditional Pharmacology to in Silico Rational Drug Design.

Authors:  Giorgio Cozza
Journal:  Pharmaceuticals (Basel)       Date:  2017-02-20

8.  Alternaria toxins as casein kinase 2 inhibitors and possible consequences for estrogenicity: a hybrid in silico/in vitro study.

Authors:  Georg Aichinger; Luca Dellafiora; Foteini Pantazi; Giorgia Del Favero; Gianni Galaverna; Chiara Dall'Asta; Doris Marko
Journal:  Arch Toxicol       Date:  2020-04-23       Impact factor: 5.153

9.  On the Mechanism of Action of Anti-Inflammatory Activity of Hypericin: An In Silico Study Pointing to the Relevance of Janus Kinases Inhibition.

Authors:  Luca Dellafiora; Gianni Galaverna; Gabriele Cruciani; Chiara Dall'Asta; Renato Bruni
Journal:  Molecules       Date:  2018-11-22       Impact factor: 4.411

10.  Multitarget Anticancer Agents Based on Histone Deacetylase and Protein Kinase CK2 inhibitors.

Authors:  Regina Martínez; Bruno Di Geronimo; Miryam Pastor; José María Zapico; Claire Coderch; Rostyslav Panchuk; Nadia Skorokhyd; Maciej Maslyk; Ana Ramos; Beatriz de Pascual-Teresa
Journal:  Molecules       Date:  2020-03-25       Impact factor: 4.411
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