| Literature DB >> 25535953 |
Masood Ahmad Rizvi1, Mehvash Zaki2, Mohd Afzal2, Manoj Mane3, Manjeet Kumar4, Bhahwal Ali Shah4, Saurabh Srivastav5, Saripella Srikrishna5, Ghulam Mustafa Peerzada1, Sartaj Tabassum6.
Abstract
New pharmacophore organoselenium compound (1) was designed, synthesized and characterized by various spectroscopic methods (IR, ESI-MS, (1)H, (13)C and (77)Se NMR) and further confirmed by X-ray crystallography. Compound 1 consists of two 3,5-bis(trifluoromethyl)phenyl units which are connected to the selenium atom via the organometallic C-Se bond. In vitro DNA binding studies of 1 was investigated by absorption and emission titration methods which revealed that 1 recognizes the minor groove of DNA in accordance with molecular docking studies with the DNA duplex. Gel electrophoretic assay demonstrates the ability of 1 to cleave pBR322 DNA through hydrolytic process which was further validated by T4 religation assay. To understand the drug-protein interaction of which ultimate molecular target was DNA, the affinity of 1 towards HSA was also investigated by the spectroscopic and molecular modeling techniques which showed hydrophobic interaction in the subdomain IIA of HSA. Furthermore, the intracellular localization of 1 was evidenced by cell imaging studies using HeLa cells.Entities:
Keywords: DFT studies; DNA binding; GPx activity; Organoselenium compound; X–ray crystallography; pBR322 hydrolytic cleavage
Mesh:
Substances:
Year: 2014 PMID: 25535953 DOI: 10.1016/j.ejmech.2014.12.014
Source DB: PubMed Journal: Eur J Med Chem ISSN: 0223-5234 Impact factor: 6.514