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  • Virtual screening for potential inhibitors of bacterial MurC and MurD ligases
    Tomašič, 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.
    Vir: Journal of molecular modeling. - ISSN 1610-2940 (Vol. 18, no. 3, 2012, str. 1063-1072)
    Vrsta gradiva - članek, sestavni del
    Leto - 2012
    Jezik - angleški
    COBISS.SI-ID - 3026289

    Povezava(-e):

    http://www.springerlink.com/content/1610-2940/preprint
    DOI

vir: Journal of molecular modeling. - ISSN 1610-2940 (Vol. 18, no. 3, 2012, str. 1063-1072)
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