Molecular dynamics simulations of 14 HIV protease mutants in complexes with indinavir
β Scribed by Xianfeng Chen; Irene T. Weber; Robert W. Harrison
- Book ID
- 106239538
- Publisher
- Springer-Verlag
- Year
- 2004
- Tongue
- English
- Weight
- 607 KB
- Volume
- 10
- Category
- Article
- ISSN
- 1610-2940
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The biological function of HIV-1 integrase (IN) is to integrate viral DNA into the host cell chromosome, and the specific binding of IN with viral DNA is a precondition for IN to function correctly. Beforehand, the binding mode of IN dimer (IN 2 ) with the 27 bp segment of viral DNA before 3' proces
## Abstract To test the anticorrelated relationship that was recently displayed in conventional molecular dynamics (MD) simulations, several different restrained MD simulations on a wild type and on the V82F/I84V drugβresistant mutant of HIVβ1 protease were performed. This anticorrelated relationsh