Computer assignment of the backbone resonances of labelled proteins using two-dimensional correlation experiments.

@article{Morelle1995ComputerAO,
  title={Computer assignment of the backbone resonances of labelled proteins using two-dimensional correlation experiments.},
  author={N Morelle and Bernhard Brutscher and Jean-Pierre Simorre and Dominique Marion},
  journal={Journal of biomolecular NMR},
  year={1995},
  volume={5 2},
  pages={
          154-60
        }
}
We present ALPS (Assignment for Labelled Protein Spectra), a flexible computer program for the automatic assignment of backbone NMR resonances of (15)N/(13)C-labelled proteins. The program constructs pseudoresidues from peak-picking lists of a set of two-dimensional triple resonance experiments and uses either a systematic search or a simulated annealing-based optimization to perform the assignment. This method has been successfully tested on two-dimensional triple resonance spectra of… CONTINUE READING