کد مقاله کد نشریه سال انتشار مقاله انگلیسی نسخه تمام متن
7843606 1506522 2018 8 صفحه PDF دانلود رایگان
عنوان انگلیسی مقاله ISI
Molecular mechanism of interactions between inhibitory tripeptide GEF and angiotensin-converting enzyme in aqueous solutions by molecular dynamic simulations
موضوعات مرتبط
مهندسی و علوم پایه شیمی شیمی تئوریک و عملی
پیش نمایش صفحه اول مقاله
Molecular mechanism of interactions between inhibitory tripeptide GEF and angiotensin-converting enzyme in aqueous solutions by molecular dynamic simulations
چکیده انگلیسی
Molecular dynamics simulations and molecular docking revealed the molecular mechanism of GEF and ACE (C-domain and N-domain). Hydrogen bonding interactions and van der Waal interactions played important roles in the binding of GEF and ACE. Three hydrogen bonds were formed mostly between GEF and C-ACE. And six hydrogen bonds existed mainly between GEF and N-ACE. The chelation between the zinc ion and ligand was the vital factor to stabilize the ligand-acceptor complexes.116
ناشر
Database: Elsevier - ScienceDirect (ساینس دایرکت)
Journal: Journal of Molecular Liquids - Volume 249, January 2018, Pages 389-396
نویسندگان
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