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Title

Molecular docking analysis of long-chain alkanes with the β-lactamase BEL-1 from P. aeruginosa

Authors

VR Gayathri1, B Prakash1,2,*, JV Yashika1, Subash Vetri Selvi3 & D. Jegadeesh Kumar4

 

Affiliation

1Department of Biotechnology, Vivekanandha College of Arts & Science for Women (Autonomous) Trichengode, Tamilnadu, India; 2Department of Biotechnology, Vels Institute of Science Technology & Advanced Studies, Chennai, Tamilnadu, India; 3Electroanalysis and Bioelectrochemistry Lab, Department of Chemical Engineering and Biotechnology, National Taipei University of Technology, Taipei 106, Taiwan, ROC; 4Chromopark Research Centre, Namakkal, Tamilnadu, India; *Corresponding Author

 

Email

Prakash B - E-mail: prakazbt@gmail.com

 

Article Type

Research Article

 

Date

Received April 6, 2022; Revised May 31, 2022; Accepted May 31, 2022, Published May 31, 2022

 

Abstract

Pseudomonas aeruginosa is a gram-negative opportunistic bacterium that is a concern worldwide due to its innate antibiotic resistance properties. This warrants the development of non-antibiotic compounds that can potentially address the growing concern. Therefore, it is of interest to document the molecular docking analysis data of three long-chain alkanes, namely, eicosane, triacontane, and nonadecane with β-lactamase BEL-1. Data shows that nonadecane have good binding features and drug-likeness when compared to triacontane and nonadecane. It is well known that nonadecane is a compound that is abundantly available from natural resources for further consideration.

 

Keywords

β-lactamase BEL-1, P. aeruginosa, nonadecane, long-chain alkanes

 

Citation

Gayathri et al. Bioinformation 18(5): 460-463 (2022)

 

Edited by

P Kangueane

 

ISSN

0973-2063

 

Publisher

Biomedical Informatics

 

License

This is an Open Access article which permits unrestricted use, distribution, and reproduction in any medium, provided the original work is properly credited. This is distributed under the terms of the Creative Commons Attribution License.