Molecular Docking and Virtual Screening of Cefazolin as a Antibiotic Drug

Authors

  • S. S. Kadam  Dnyaneshwar Gramonnati Mandal's HON. Balasaheb Jadhav Arts, Commmerce & Science College, Ale, Tal- Junnar, Dist- Pune Maharashtra, India

Keywords:

Molecular Docking, Pharmacophore, Cefazolin, Computer Aided Drug Design

Abstract

In this research paper Schrodinger software based pharmacophore features of cefazolin mapping and distance involved between 1,3,4- thiadiazole ring and other pharmacophore features of the compound is elaborated. The structure of Cefazolin is observed on Zincpharmer online server to reveal the various intermolecular features for molecular recognition, investigation of binding site (ligand-receptor complexes), characterization of unknown binding sites etc., Computer Aided Drug Design is successfully identified the flexibility of binding sites of target molecule with small ligand based on lock and key model. In Silico evaluation based on SBDD and MD is very useful tool to identify the pharmacofeatures and pharmacological significance of molecules before they synthesized. In the published research papers revealed on synthesized derivatives of 1, 3,4-thidiazole and their biological evaluation in vitro against NCIM provided Gram positive bacterial strains Staphallococcus aureus (Sa- 2178) Bacillus subtilis (Bs-2239) Gram negative bacterial strains Eschereschia coli (Ec-25744) Klibesiella aerogenus (Ka-2249).

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International Journal of Scientific Research in Science and Technology

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Published

2019-01-04

Issue

Volume 5, Issue 4, January-2019

Section

Research Articles

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How to Cite

[1]
S. S. Kadam, " Molecular Docking and Virtual Screening of Cefazolin as a Antibiotic Drug , International Journal of Scientific Research in Science and Technology(IJSRST), Online ISSN : 2395-602X, Print ISSN : 2395-6011, Volume 5, Issue 4, pp.129-134, January-2019.