Homology modeling of human extracellular signal-regulated kinase 1 and docking and reconstitution of its inhibitors

Acta Chimica Sinica

Volumn 68, Issue 3, 2010, Pages 222-226

  Zhang, Jilong ^a   Hou, Ruizhe ^b   Li, Zhuo ^a   Zheng, Qingchuan ^a   Zhang, Hongxing ^a  

^a JILIN UNIVERSITY   (China)

^b Basic Medical College   (China)

Author keywords

hERK1; Homology modeling; Inhibitors; Molecular docking; Molecular dynamics

Indexed keywords

EID: 79952312050     PISSN: 05677351     EISSN: None     Source Type: Journal    
DOI: None     Document Type: Article

References (18)

1. Sebolt-Leopold J. S., Herrera R. Nat. Rev. Cancer 2004, 4, 937.
2. Smalley K. S. M. Int. J. Cancer 2003, 104, 527.
3. Kohno M., Pouyssegur J. Ann. Med. 2006, 38, 200.
4. Hilger R. A., Scheulen M. E., Strumberg D. Onkologie 2002, 25, 511.
5. Herrera R., Sebolt-Leopold J. S. Trends Mol. Med. 2002, 8, S27.
6. Kyriakis J. M., Avruch J. Physiol. Rev. 2001, 81, 807.
7. Ho A. K., Hashimoto K., Chik C. L. J. Neurochem. 1999, 73, 598.
8. Lefloch R., Pouyssegur J., Lenormand P. Mol. Cell. Biol. 2008, 28, 511.
9. Aronov A. M., Baker C., Bemis G. W., Cao J. R., Chen G. J., Ford P. J., Germamm U. A., Green J., Hale M. R., Jacobs M., Janetka J. W., Maltais F., Martinez-Botella G., Namchuk M. N., Straub J., Tang Q., Xie X. L. J. Med. Chem. 2007, 50, 1280.
10. Hu G. D., Zhang S. L., Zhang Q. G. Acta Chim. Sinica 2009, 67, 1019 (in Chinese).
11. Ma G. Z., Liu C., Qiu Y. F., Nan J. M. Acta Chim. Sinica 2009, 67, 453 (in Chinese).
12. Humphrey W., Dalke A., Schulten K. J. Mol. Graphics Modell. 1996, 14, 33.
13. Kale L., Skeel R., Bhandarkar M., Brunner R., Gursoy A., Krawetz N., Phillips J., Shinozaki A., Varadaraian K., Schulten K. J. Comput. Phys. 1999, 151, 283.
14. MacKerell A. D. Jr., Bashford D., Bellott M., Dunbrack R. L. Jr., Evanseck J. D., Field M. J., Fischer S., Gao J., Guo H., Ha S., Joseph-McCarthy D., Kuchnir L., Kuczera K., Lau F. T. K., Mattos C., Michnick S., Ngo T., Nguyen D. T., Prodhom B., Reiher W. E. III, Roux B., Schlenkrich M., Smith J. C., Stote R., Straub J., Watanabe M., Wiórkiewicz-Kuczera J., Yin D., Karplus M. J. Phys. Chem. B 1998, 102, 3586.
15. Insight II, Molecular Simulation Inc., San Diego, 2000.
16. Morris A. L., MacArthur M. W., Hutchinson E. G., Thornton J. M. Proteins 1992, 12, 345.
17. Discovery Studio 2.1, Accelrys Inc. San Diego, CA 92121, USA, 2008.
18. Foloppe N., Fisher L. M., Howes R., Kierstan P., Potter A., Robertson A. G. S., Surgenor A. E. J. Med. Chem. 2005, 48, 4332.