Method and system for protein modeling

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364578, G01N 3700

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055575358

ABSTRACT:
A method in a computer system for modeling a three-dimensional structure of a model protein is provided. In a preferred embodiment, the modeling is based upon a three-dimensional structure of a template protein and an amino acid sequence alignment of the model protein and the template protein. The proteins comprise a plurality of amino acids having backbone atoms and side chain atoms. For each amino acid in the model protein, when the template protein has an amino acid aligned with the amino acid of the model protein, the position of each backbone atom of the amino acid of the model protein is established based on the position of a topologically equivalent backbone atom in the aligned amino acid of the template protein. The inter-atomic distance constraints for each pair of atoms with an established position is generated. Finally, the position of each atom in the model protein is set so that the inter-atomic distances are in accordance with the constraints.

REFERENCES:
patent: 4881175 (1989-11-01), Ladner
patent: 4908773 (1990-03-01), Pantoliano et al.
patent: 5025388 (1991-06-01), Cramer, III et al.
patent: 5241470 (1993-08-01), Lee et al.
patent: 5260882 (1993-11-01), Blanco et al.
patent: 5307287 (1994-04-01), Cramer, III et al.
patent: 5420805 (1995-05-01), Still et al.
patent: 5436850 (1995-07-01), Eisenberger et al.
Srinivasan et al; "An Evaluation of the Performance of an Automated Procedure for Comparative Modelling of Protein Tertiary Structure"; Protein Engineering vol. 6, No. 5, pp. 501-512 (1993).
Baldi et al; "Hidden Markov Models of Biological Primary Sequence Information"; Proceeding of the National Academy of Science, USA, 1994.
Brooks et al., "CHARMM: A Program for Macromolecular Energy, Minimization, and Dynamics Caculations,"Journal of Computational Chemistry, vol. 4, No. 2, 1983, pp. 187-217.
Srinivasan, Subhashini et al., "Multistep Modeling of Protein Structure: Application to Bungarotoxin," International Journal of Quantum Chemistry: Quantum Biology Symposium 13, 1986, pp. 167-174.
Havel, Timothy, and Mark E. Snow, "A New Method For Building Protein Conformations From Sequence Alignments With Homologues of Known Structure," J. Mol. Biol., 1991, pp. 1-7.

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