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Origins of barriers and barrierless folding in BBL.


ABSTRACT: In contrast to classical chemical phenomenology, theory suggests that proteins may undergo downhill folding without an activation barrier under certain thermodynamic conditions. Recently, the BBL protein was proposed to fold by such a downhill scenario, but discrepancies between experimental results found in different groups argue against this. After briefly reviewing the major experimental studies of the BBL folding mechanism, we show that simulations of both coarse-grained and atomistic models can reconcile the seemingly conflicting observations.

SUBMITTER: Cho SS 

PROVIDER: S-EPMC2224170 | biostudies-literature | 2008 Jan

REPOSITORIES: biostudies-literature

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Origins of barriers and barrierless folding in BBL.

Cho Samuel S SS   Weinkam Patrick P   Wolynes Peter G PG  

Proceedings of the National Academy of Sciences of the United States of America 20080102 1


In contrast to classical chemical phenomenology, theory suggests that proteins may undergo downhill folding without an activation barrier under certain thermodynamic conditions. Recently, the BBL protein was proposed to fold by such a downhill scenario, but discrepancies between experimental results found in different groups argue against this. After briefly reviewing the major experimental studies of the BBL folding mechanism, we show that simulations of both coarse-grained and atomistic models  ...[more]

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