Mechanisms of damage to DNA labeled with electrophilic nucleobases induced by ionizing or UV radiation

J Rak, L Chomicz, J Wiczk, K Westphal… - The Journal of …, 2015 - ACS Publications
Hypoxia a hallmark of solid tumors makes hypoxic cells radioresistant. On the other
hand, DNA, the main target of anticancer therapy, is not sensitive to the near UV photons …

Nitro rotation tuned dissociative electron attachment upon targeted radiosensitizer 4-substituted Z bases

X Cui, Y Zhao, C Zhang, Q Meng - Physical Chemistry Chemical …, 2022 - pubs.rsc.org
In this work, a set of new potential radiation sensitizers (4-substituted Z-bases: 4XZ, X= F, Cl,
Br, and I) are designed based on the artificial 6-amino-5-nitro-3-(1′-β-D-2 …

Irreversible electron attachment–a key to DNA damage by solvated electrons in aqueous solution

K Westphal, J Wiczk, J Miloch, G Kciuk… - Organic & …, 2015 - pubs.rsc.org
The TYT and TXT trimeric oligonucleotides, where X stands for a native nucleobase, T
(thymine), C (cytosine), A (adenine), or G (guanine), and Y indicates a brominated analogue …

DNA Damage Radiosensitizers Geared Towards Hydrated Electrons

M Zdrowowicz, L Chomicz-Mańka, K Butowska… - Practical Aspects of …, 2022 - Springer
Hypoxia, a hallmark of solid tumors, which account for ca. 80% of cancer cases, makes the
cancer cells resistant toward ionizing radiation and as a consequence to radiotherapy, one …

Effects of substituent and excess electron attachment on proton transfer between the radiosensitizer base pairs in aqueous solution

C Zhang, X Cui, Y Zhao, L Duan, X Zhang… - Journal of Molecular …, 2022 - Elsevier
We investigate the proton transfer reaction of radiosensitizing drugs 5-substituted thymine-
adenine (5XT-A, X= Br, OCN) in water solutions through the density functional theory (DFT) …

Dissociative electron attachment to halogenated nucleotides: a quest for better radiosensitizers

S Kumar, M Sarma - Physical Chemistry Chemical Physics, 2024 - pubs.rsc.org
Tumor hypoxia hampers radiotherapy efficacy, necessitating radiosensitizers. Substituted
nucleobases offer advantages as radiosensitizers. They can be incorporated into DNA with …

Why 6-Iodouridine Cannot Be Used as a Radiosensitizer of DNA Damage? Computational and Experimental Studies

K Falkiewicz, W Kozak, M Zdrowowicz… - The Journal of …, 2023 - ACS Publications
Previous density functional theory (DFT) studies on 6-brominated pyrimidine nucleosides
suggest that 6-iodo-2′-deoxyuridine (6IdU) should act as a better radiosensitizer than its 5 …

Mechanisms responsible for high energy radiation induced damage to single-stranded DNA modified by radiosensitizing 5-halogenated deoxyuridines

S Wang, P Zhao, C Zhang, Y Bu - The Journal of Physical …, 2016 - ACS Publications
Experimental studies showed that high energy radiation induced base release and DNA
backbone breaks mainly occur at the neighboring 5′ nucleotide when a single-stranded …

Intramolecular charge transfer in 5-halogen cytidines revealed by femtosecond time-resolved spectroscopy

R Xu, Z Hu, X Wang, Y Liu, Z Zhou, J Xu… - The Journal of …, 2020 - ACS Publications
Ultraviolet radiation induced damage to DNA/RNA can lead to chemical modifications to the
nucleosides, and understanding the excited states involved is the key to reveal the …

Cytosine Iminyl Radical (cytN) Formation via Electron-Induced Debromination of 5-Bromocytosine: A DFT and Gaussian 4 Study

A Kumar, MD Sevilla - The Journal of Physical Chemistry A, 2017 - ACS Publications
Halogen-substituted pyrimidines, such as 5-bromouracil and 5-iodouracil, have been used
as radio therapeutic (RT) agents in cancer treatment. The radiosensitizing activity of 5 …