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Virtual screening for potential inhibitors of bacterial MurC and MurD ligasesTomašič, Tihomir ...Mur ligases are bacterial enzymes involved in the cytoplasmic steps of peptidoglycan biosynthesis and are viable targets for antibacterial drug discovery. We have performed virtual screening for ... potential ATP-competitive inhibitors targeting MurC and MurD ligases, using a protocol of consecutive hierarchical filters. Selected compounds were evaluated for inhibition of MurCand MurD ligases, and weak inhibitors possessing dual inhibitory activity have been identified. These compounds represent new scaffolds for further optimisation towards multiple Mur ligase inhibitors with improved inhibitory potency.Source: Journal of molecular modeling. - ISSN 1610-2940 (Vol. 18, no. 3, 2012, str. 1063-1072)Type of material - article, component partPublish date - 2012Language - englishCOBISS.SI-ID - 3026289
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Database name | Field | Year |
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Links to authors' personal bibliographies | Links to information on researchers in the SICRIS system |
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Tomašič, Tihomir | 28334 |
Kovač, Andreja, farmacevtka, 1979- | 27782 |
Klebe, Gerhard | |
Blanot, Didier | |
Gobec, Stanislav, 1970- | 15284 |
Kikelj, Danijel | 01463 |
Peterlin-Mašič, Lucija | 19317 |
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