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Journal of Chemistry
Volume 2015, Article ID 879238, 13 pages
Research Article

Study on Molecular Recognition between Euphorbia Factor L713283 and β-Tubulin via Molecular Simulation Methods

1Institute of Bioinformatics and Medical Engineering, School of Electrical and Information Engineering, Jiangsu University of Technology, Changzhou 213001, China
2Chongqing High-Tech Industrial Development Zone, Chongqing 400039, China
3Faculty of Biotechnology Industry, Chengdu University, Chengdu 610106, China
4College of Chemistry, Leshan Normal University, Leshan 614004, China

Received 26 August 2015; Revised 25 October 2015; Accepted 28 October 2015

Academic Editor: Teodorico C. Ramalho

Copyright © 2015 Shan Chang et al. This is an open access article distributed under the Creative Commons Attribution License, which permits unrestricted use, distribution, and reproduction in any medium, provided the original work is properly cited.

Supplementary Material

Figure S1. The structure of L713283 with atomic number.

Figure S2. Superimposition between 1JFF crystal structure and the re-docked model of Taxol molecule with β-tubulin.

Figure S3. The binding modes of β-tubulin with the representative conformation of L713283 in the 5th~11th cluster, which are shown in red, green, blue, yellow, violet, cyan, orange, respectively.

Figure S4. The geometry parameter for the hydrogen bond between L713283 and β-tubulin. (A) Distance of donor atom with acceptor atom. (B) Angle of donor atom, hydrogen atom and acceptor atom.

  1. Supplementary Material