murd ligase Latest Research Papers

Identification of novel natural MurD ligase inhibitors as potential antimicrobial agents targeting Acinetobacter baumannii: In silico screening and biological evaluation

Journal of Biomolecular Structure and Dynamics ◽

10.1080/07391102.2021.2000497 ◽

2021 ◽

pp. 1-16

Author(s):

Pragya Tiwari ◽

Priyanka Sharma ◽

Mukesh Kumar ◽

Arti Kapil ◽

Ethayathulla Abdul Samath ◽

...

Keyword(s):

Acinetobacter Baumannii ◽

In Silico ◽

Antimicrobial Agents ◽

Biological Evaluation ◽

In Silico Screening ◽

Murd Ligase

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Identification of promising molecules against MurD ligase from Acinetobacter baumannii: insights from comparative protein modelling, virtual screening, molecular dynamics simulations and MM/PBSA analysis

Journal of Molecular Modeling ◽

10.1007/s00894-020-04557-4 ◽

2020 ◽

Vol 26 (11) ◽

Author(s):

Rajat Kumar Jha ◽

Rameez Jabeer Khan ◽

Gizachew Muluneh Amera ◽

Ekampreet Singh ◽

Amita Pathak ◽

...

Keyword(s):

Molecular Dynamics ◽

Virtual Screening ◽

Molecular Dynamics Simulations ◽

Acinetobacter Baumannii ◽

Protein Modelling ◽

Dynamics Simulations ◽

Murd Ligase

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Molecular modeling, simulation and virtual screening of MurD ligase protein from Salmonella typhimurium LT2

Journal of Pharmacological and Toxicological Methods ◽

10.1016/j.vascn.2015.03.005 ◽

2015 ◽

Vol 73 ◽

pp. 34-41 ◽

Cited By ~ 10

Author(s):

Himanshu Bhusan Samal ◽

Jugal Kishore Das ◽

Rajani Kanta Mahapatra ◽

Mrutyunjay Suar

Keyword(s):

Molecular Modeling ◽

Virtual Screening ◽

Salmonella Typhimurium ◽

Modeling Simulation ◽

Murd Ligase

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A novel 2-oxoindolinylidene inhibitor of bacterial MurD ligase: Enzyme kinetics, protein-inhibitor binding by NMR and a molecular dynamics study

European Journal of Medicinal Chemistry ◽

10.1016/j.ejmech.2014.06.021 ◽

2014 ◽

Vol 83 ◽

pp. 92-101 ◽

Cited By ~ 5

Author(s):

Mihael Simčič ◽

Kaja Pureber ◽

Katja Kristan ◽

Uroš Urleb ◽

Darko Kocjan ◽

...

Keyword(s):

Molecular Dynamics ◽

Enzyme Kinetics ◽

Protein Inhibitor ◽

Inhibitor Binding ◽

Murd Ligase

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Inhibitor Design Strategy Based on an Enzyme Structural Flexibility: A Case of Bacterial MurD Ligase

Journal of Chemical Information and Modeling ◽

10.1021/ci500104m ◽

2014 ◽

Vol 54 (5) ◽

pp. 1451-1466 ◽

Cited By ~ 15

Author(s):

Andrej Perdih ◽

Martina Hrast ◽

Hélène Barreteau ◽

Stanislav Gobec ◽

Gerhard Wolber ◽

...

Keyword(s):

Design Strategy ◽

Structural Flexibility ◽

Inhibitor Design ◽

Murd Ligase

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Molecular dynamics simulation and linear interaction energy study of d-Glu-based inhibitors of the MurD ligase

Journal of Computer-Aided Molecular Design ◽

10.1007/s10822-013-9673-3 ◽

2013 ◽

Vol 27 (8) ◽

pp. 723-738 ◽

Cited By ~ 22

Author(s):

Andrej Perdih ◽

Gerhard Wolber ◽

Tom Solmajer

Keyword(s):

Molecular Dynamics ◽

Molecular Dynamics Simulation ◽

Interaction Energy ◽

Dynamics Simulation ◽

Linear Interaction ◽

Linear Interaction Energy ◽

Murd Ligase

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Homology modeling, molecular dynamics and inhibitor binding study on MurD ligase of Mycobacterium tuberculosis

Interdisciplinary Sciences Computational Life Sciences ◽

10.1007/s12539-012-0133-x ◽

2012 ◽

Vol 4 (3) ◽

pp. 223-238 ◽

Cited By ~ 13

Author(s):

Akanksha Arvind ◽

Vivek Kumar ◽

Parameswaran Saravanan ◽

C. Gopi Mohan

Keyword(s):

Molecular Dynamics ◽

Mycobacterium Tuberculosis ◽

Homology Modeling ◽

Binding Study ◽

Inhibitor Binding ◽

Murd Ligase

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MurD ligase from Escherichia coli: C-terminal domain closing motion

Computational and Theoretical Chemistry ◽

10.1016/j.comptc.2011.10.018 ◽

2012 ◽

Vol 979 ◽

pp. 73-81 ◽

Cited By ~ 13

Author(s):

Andrej Perdih ◽

Tom Solmajer

Keyword(s):

Escherichia Coli ◽

Terminal Domain ◽

Murd Ligase

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New 5-benzylidenethiazolidin-4-one inhibitors of bacterial MurD ligase: Design, synthesis, crystal structures, and biological evaluation

European Journal of Medicinal Chemistry ◽

10.1016/j.ejmech.2011.09.017 ◽

2011 ◽

Vol 46 (11) ◽

pp. 5512-5523 ◽

Cited By ~ 32

Author(s):

Nace Zidar ◽

Tihomir Tomašić ◽

Roman Šink ◽

Andreja Kovač ◽

Delphine Patin ◽

...

Keyword(s):

Crystal Structures ◽

Biological Evaluation ◽

Design Synthesis ◽

Murd Ligase

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Novel 2-thioxothiazolidin-4-one inhibitors of bacterial MurD ligase targeting d-Glu- and diphosphate-binding sites

European Journal of Medicinal Chemistry ◽

10.1016/j.ejmech.2011.05.070 ◽

2011 ◽

Vol 46 (9) ◽

pp. 3964-3975 ◽

Cited By ~ 28

Author(s):

Tihomir Tomašić ◽

Andreja Kovač ◽

Mihael Simčič ◽

Didier Blanot ◽

Simona Golič Grdadolnik ◽

...

Keyword(s):

Binding Sites ◽

Murd Ligase

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murd ligase
Recently Published Documents

TOTAL DOCUMENTS

H-INDEX

Identification of novel natural MurD ligase inhibitors as potential antimicrobial agents targeting Acinetobacter baumannii: In silico screening and biological evaluation

Identification of promising molecules against MurD ligase from Acinetobacter baumannii: insights from comparative protein modelling, virtual screening, molecular dynamics simulations and MM/PBSA analysis

Molecular modeling, simulation and virtual screening of MurD ligase protein from Salmonella typhimurium LT2

A novel 2-oxoindolinylidene inhibitor of bacterial MurD ligase: Enzyme kinetics, protein-inhibitor binding by NMR and a molecular dynamics study

Inhibitor Design Strategy Based on an Enzyme Structural Flexibility: A Case of Bacterial MurD Ligase

Molecular dynamics simulation and linear interaction energy study of d-Glu-based inhibitors of the MurD ligase

Homology modeling, molecular dynamics and inhibitor binding study on MurD ligase of Mycobacterium tuberculosis

MurD ligase from Escherichia coli: C-terminal domain closing motion

New 5-benzylidenethiazolidin-4-one inhibitors of bacterial MurD ligase: Design, synthesis, crystal structures, and biological evaluation

Novel 2-thioxothiazolidin-4-one inhibitors of bacterial MurD ligase targeting d-Glu- and diphosphate-binding sites

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murd ligaseRecently Published Documents

TOTAL DOCUMENTS

H-INDEX

Identification of novel natural MurD ligase inhibitors as potential antimicrobial agents targeting Acinetobacter baumannii: In silico screening and biological evaluation

Identification of promising molecules against MurD ligase from Acinetobacter baumannii: insights from comparative protein modelling, virtual screening, molecular dynamics simulations and MM/PBSA analysis

Molecular modeling, simulation and virtual screening of MurD ligase protein from Salmonella typhimurium LT2

A novel 2-oxoindolinylidene inhibitor of bacterial MurD ligase: Enzyme kinetics, protein-inhibitor binding by NMR and a molecular dynamics study

Inhibitor Design Strategy Based on an Enzyme Structural Flexibility: A Case of Bacterial MurD Ligase

Molecular dynamics simulation and linear interaction energy study of d-Glu-based inhibitors of the MurD ligase

Homology modeling, molecular dynamics and inhibitor binding study on MurD ligase of Mycobacterium tuberculosis

MurD ligase from Escherichia coli: C-terminal domain closing motion

New 5-benzylidenethiazolidin-4-one inhibitors of bacterial MurD ligase: Design, synthesis, crystal structures, and biological evaluation

Novel 2-thioxothiazolidin-4-one inhibitors of bacterial MurD ligase targeting d-Glu- and diphosphate-binding sites

murd ligase
Recently Published Documents