التفاصيل البيبلوغرافية
| العنوان: |
Identification of Natural Compounds as CTX-M-15 Inhibitors for the Management of Multidrug-Resistant Bacteria: An in-silico study |
| المؤلفون: |
Alam, Mohammad Zubair, Haque, Absarul |
| المساهمون: |
This project was funded by the Deanship of Scientific Research (DSR) at King Abdulaziz University, Jeddah, under grant no. (G-529-141-1436). The author, therefore, acknowledges with thanks DSR for technical and financial support. |
| المصدر: |
Advancements in Life Sciences; Vol 10, No 4 (2023): Advancements in Life Sciences; 543-548 ; 2310-5380 |
| بيانات النشر: |
The RunningLine |
| سنة النشر: |
2024 |
| المجموعة: |
Advancements in Life Sciences (E-Journal, University of the Punjab) |
| مصطلحات موضوعية: |
Microbiology, Biotechnology, Bioinformatics, Bacteriology |
| الوصف: |
Background: Antibiotic resistance is a major global threat to the efficacy of bacterial infection treatment. Resistance to beta-lactam antibiotics in bacteria is primarily caused by the production of extended-spectrum-lactamases, with the CTX-M variant, particularly CTX-M-15, being the most common. The need for an effective CTX-M-15 inhibitor is currently pressing.Methods: This study screened a library of natural compounds from the ZINC database against the CTX-M-15 protein using the PyRx 0.8 tool. The SwissADME web platform was used to predict the ADMET properties of the five most promising compounds.Result: The identified hits compounds, ZINC1857626342, ZINC403692, ZINC408773, ZINC57926, and ZINC790938591 exhibited strong binding with CTX-M-15. These compounds interacted with crucial catalytic site residues in the CTX-M-15 protein, particularly Ser70 and Ser130. Notably, the binding energies of these compounds were higher than those of the reference compound avibactam. Furthermore, they exhibited pharmacologically favorable characteristics.Conclusion: These compounds show promise as potential CTX-M-15 inhibitors to combat bacterial resistance. However, more experimental research is needed to optimize these compounds for their role as CTX-M-15 inhibitors. |
| نوع الوثيقة: |
article in journal/newspaper |
| وصف الملف: |
application/pdf |
| اللغة: |
English |
| Relation: |
https://submission.als-journal.com/index.php/ALS/article/view/2615/1285; https://submission.als-journal.com/index.php/ALS/article/view/2615 |
| الاتاحة: |
https://submission.als-journal.com/index.php/ALS/article/view/2615 |
| Rights: |
Copyright (c) 2023 Advancements in Life Sciences |
| رقم الانضمام: |
edsbas.2F364AD6 |
| قاعدة البيانات: |
BASE |