Title :
Docking arachidonic acid into human 5/12-lipoxygenase using ICM
Author :
Bai, Mingmin ; Khosravi, Ebrahim ; Bai, Shuju
Author_Institution :
Dept. of Comput. Sci., Southern Univ., Baton Rouge, LA, USA
Abstract :
In this research, we modeled the interactions between 5-LOX/12LOX and their substrate arachidonic acid (AA). The crystal structure of human 5-LOX and 12-LOX were obtained from protein data bank. Internal Coordinated Mechanics (ICM) was used to perform the docking.
Keywords :
biochemistry; crystal structure; enzymes; molecular biophysics; molecular configurations; 5-LOX-12LOX-arachidonic acid interaction; ICM; crystal structure; human 5-12-Lipoxygenase; internal coordinated mechanics; protein data bank; substrate arachidonic acid; Conferences; Crystals; Humans; Protein engineering; Proteins; Substrates; Arachidonic acid; ICM docking; Lipoxygenase; interaction of protein and substrate;
Conference_Titel :
Bioinformatics and Biomedicine Workshops (BIBMW), 2011 IEEE International Conference on
Conference_Location :
Atlanta, GA
Print_ISBN :
978-1-4577-1612-6
DOI :
10.1109/BIBMW.2011.6112526
