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Effect of Cu(II) compound containing dipicolinic acid on DNA damage: a study of antiproliferative activity and DNA interaction properties by spectroscopic, molecular docking and molecular dynamics approaches.
Journal of Biomolecular Structure & Dynamics 2024 March 19
A polymeric compound formulized as [Cu(µ-dipic)2 {Na2 (µ-H2 O)4 ]n .2nH2 O ( I ), where dipic is 2,6-pyridine dicarboxylic acid (dipicolinic acid, H2 dipic), was synthesized by sonochemical irradiation. The initial in-vitro cytotoxic activity of this complex compared with renowned anticancer drugs like cisplatin, versus HCT116 colon cell lines, shows promising results. This study investigated the interaction mode between compound ( I ) and calf-thymus DNA utilizing a range of analytical techniques including spectrophotometry, fluorimetry, partition coefficient analysis, viscometry, gel electrophoresis and molecular docking technique. The results obtained from experimental methods reveal complex ( I ) could bind to CT-DNA via hydrogen bonding and van der Waals forces and the theoretical methods support it. Also, complex ( I ) indicates nuclease activity in the attendance of H2 O2 and can act as an artificial nuclease to cleave DNA with high efficiency.Communicated by Ramaswamy H. Sarma.
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