Building a Full-Atom Model of L,D-transpeptidase 2 from Mycobacterium tuberculosis for Screening New Inhibitorsстатья
Информация о цитировании статьи получена из
Web of Science,
Scopus
Статья опубликована в журнале из перечня ВАК
Статья опубликована в журнале из списка Web of Science и/или Scopus
Дата последнего поиска статьи во внешних источниках: 23 ноября 2017 г.
Местоположение издательства:Moscow, Russia (Federation)
Первая страница:44
Последняя страница:51
Аннотация:L,D-transpeptidase 2 from Mycobacterium tuberculosis plays a key role in the formation of the cell
wall of a pathogen and catalyzes the cross-linking of growing peptidoglycan chains by non-classical 3-3 bonds, which causes resistance to a broad spectrum of penicillins. Molecular modeling of enzyme interactions with the N- and C-terminal tetrapeptide fragments of growing peptidoglycan chains has been performed for the first time and has allowed us to highlight the peculiarities of their binding at the formation of 3-3 cross-linkages, as well as to build a full-atom model of L,D-transpeptidase 2 for the screening and optimizing of inhibitors’ structures.