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Exploring Protein Sequence Space Using Knowledge-Based Potentials

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Author Info
Aderonke Babajide
Robert Farber
Ivo L. Hofacker
Jeff Inman
Alan S. Lapedes
Peter F. Stadler
Abstract

Knowledge-based potentials can be used to decide whether an amino acid sequence is likely to fold into a prescribed native protein structure. We use this idea to survey the sequence-structure relations in protein space. In particular, we test the following two propositions which were found to be important for efficient evolution: The sequences folding into a particular native fold form extensive neutral networks that percolate through sequence space. The neutral networks of any two native folds approach each other to within a few point mutations. Computer simulations using two very different potential functions, M.Sippl's PROSA pair potential and a neural network based potential, are used to verify these claims.

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Publisher Info
Paper provided by Santa Fe Institute in its series Working Papers with number 98-11-103.

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Date of creation: Nov 1998
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Handle: RePEc:wop:safiwp:98-11-103

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Related research
Keywords: Knowledge-based potentials; inverse folding; neutral networks; protein evolution;

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