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Generation of soluble oligomeric beta-amyloid species via copper catalyzed oxidation with implications for Alzheimer's disease : A DFT study

Haeffner, Fredrik (author)
KTH,Fysikalisk kemi
Barnham, Kevin J. (author)
Bush, Ashley I. (author)
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Brinck, Tore (author)
KTH,Fysikalisk kemi
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 (creator_code:org_t)
2009-11-20
2010
English.
In: Journal of Molecular Modeling. - : Springer Science and Business Media LLC. - 1610-2940 .- 0948-5023. ; 16:6, s. 1103-1108
  • Journal article (peer-reviewed)
Abstract Subject headings
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  • A mechanism for the oxidation of a dimeric beta-amyloid copper ion complex is proposed based on DFT calculations. It involves the Met35 residue, which is believed to be important in the neurotoxicity causing Alzheimer's disease. Oxidation of Met35 is found to proceed readily with dioxygen when two Met35 residues are close to each other and the copper ion. This indicates that oxidants, such as hydrogen peroxide, are not necessary for oxidation of beta-amyloid copper ion complexes. Understanding these processes could be pivotal in gaining more knowledge of this complex disease and for the development of therapeutic treatments.

Subject headings

NATURVETENSKAP  -- Kemi (hsv//swe)
NATURAL SCIENCES  -- Chemical Sciences (hsv//eng)

Keyword

Alzheimer's disease
beta-amyloid
Copper ion
Met35
Molecular modeling
Oxidation
Chemistry
Kemi

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ref (subject category)
art (subject category)

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Haeffner, Fredri ...
Barnham, Kevin J ...
Bush, Ashley I.
Brinck, Tore
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NATURAL SCIENCES
NATURAL SCIENCES
and Chemical Science ...
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Journal of Molec ...
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Royal Institute of Technology

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