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Structural effects of radiation damage and its potential for phasing

  1. Author:
    Banumathi, S.
    Zwart, P. H.
    Ramagopal, U. A.
    Dauter, M.
    Dauter, Z.
  2. Author Address

    Dauter, Z, Brookhaven Natl Lab, Natl Canc Inst, MCL, Synchrotron Radiat Res Sect, Upton, NY 11973 USA Brookhaven Natl Lab, Natl Canc Inst, MCL, Synchrotron Radiat Res Sect, Upton, NY 11973 USA. Brookhaven Natl Lab, SAIC frederick Inc, Basic Res Program, Upton, NY 11973 USA.
    1. Year: 2004
  1. Journal: Acta Crystallographica Section D-Biological Crystallography
    1. 60
    2. Part 6
    3. Pages: 1085-1093
  2. Type of Article: Article
  1. Abstract:

    A detailed analysis of radiation-damage-induced structural and intensity changes is presented on the model protein thaumatin. Changes in reflection intensities induced by irradiation display a parabolic character. The most pronounced structural changes observed were disulfide-bond breakage and associated main-chain and side-chain movements as well as decarboxylation of aspartate and glutamate residues. The structural changes induced on the sulfur atoms were successfully used to obtain high-quality phase estimates via an RIP procedure. Results obtained with ACORN suggest that the contribution originating from the partial structure may play an important role in phasing even at less than atomic resolution

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