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Molecular dynamics simulation of the opposite-base preference and interactions in the active site of formamidopyrimidine-DNA glycosylase.

Alexander V PopovAnton V EndutkinYuri N VorobjevDmitry O Zharkov
Published in: BMC structural biology (2017)
Overall, the discrimination against A opposite to the lesion seems to be due to incorrect DNA distortion around the lesion-containing base pair and, possibly, to gross movement of protein domains connected by the linker.
Keyphrases
  • molecular dynamics simulations
  • circulating tumor
  • cell free
  • single molecule
  • molecular docking
  • nucleic acid
  • circulating tumor cells
  • amino acid
  • protein protein
  • dna damage