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镧掺杂二氧化铈量子点:新型染料降解剂、抗菌活性及分子对接分析

La-Doped CeO Quantum Dots: Novel Dye Degrader, Antibacterial Activity, and Molecular Docking Analysis.

作者信息

Shahzadi Anum, Moeen Sawaira, Khan Aryan Dilawar, Haider Ali, Haider Junaid, Ul-Hamid Anwar, Nabgan Walid, Shahzadi Iram, Ikram Muhammad, Al-Shanini Ali

机构信息

Faculty of Pharmacy, The University of Lahore, Lahore 54000, Pakistan.

Solar Cell Applications Research Lab, Department of Physics, Government College University Lahore, Lahore 54000, Punjab, Pakistan.

出版信息

ACS Omega. 2023 Feb 20;8(9):8605-8616. doi: 10.1021/acsomega.2c07753. eCollection 2023 Mar 7.

Abstract

The current work demonstrates a novel synthesis of different concentrations of La-doped (2, 4, and 6 wt %) CeO quantum dots (QDs) using a hydrothermal approach. This research aimed to examine the dye degradation efficiency, antibacterial activity, and molecular docking analysis of La-doped CeO QDs. The structure, elemental composition, optical properties, -spacing, and morphological features of QDs were examined using various methods. XRD spectra exhibited the cubic structure of CeO, and the crystallinity was suppressed upon La doping. TEM revealed the formation of cubic-shaped QDs of CeO, and the incorporation of La decreased agglomeration. UV-vis absorption spectra showed a red shift upon La doping, assigned to a decrease in band gap energy. 6% La-doped CeO showed significant antibacterial activity against at higher concentrations in comparison to ciprofloxacin. La-CeO was proposed as a putative inhibitor of β-lactamase and DNA gyrase relying on the outcomes of a molecular docking analysis that was in improved accord with bactericidal activity. Moreover, the prepared QDs exhibited a remarkable photocatalytic degradation of methylene blue in a basic medium.

摘要

当前的工作展示了一种使用水热法合成不同浓度(2%、4%和6%重量)的镧掺杂氧化铈量子点(QDs)的新方法。本研究旨在考察镧掺杂氧化铈量子点的染料降解效率、抗菌活性以及分子对接分析。使用各种方法对量子点的结构、元素组成、光学性质、晶格间距和形态特征进行了研究。X射线衍射光谱显示了氧化铈的立方结构,并且在镧掺杂后结晶度受到抑制。透射电子显微镜显示形成了立方形状的氧化铈量子点,并且镧的掺入减少了团聚。紫外可见吸收光谱显示在镧掺杂后出现红移,这归因于带隙能量的降低。与环丙沙星相比,6%镧掺杂的氧化铈在较高浓度下对[具体细菌]显示出显著的抗菌活性。基于分子对接分析的结果,镧 - 氧化铈被认为是β - 内酰胺酶和DNA促旋酶的假定抑制剂,这与杀菌活性有更好的一致性。此外,制备的量子点在碱性介质中对亚甲基蓝表现出显著的光催化降解作用。

https://cdn.ncbi.nlm.nih.gov/pmc/blobs/4b5e/9996582/76f05acc982c/ao2c07753_0001.jpg

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