ISSN:
1573-5001
Keywords:
Molecular dynamics
;
Time-averaged distance NMR restraints
;
Calcitonin
;
Conformational flexibility
;
SDS
Source:
Springer Online Journal Archives 1860-2000
Topics:
Biology
,
Chemistry and Pharmacology
Notes:
Summary We have investigated the conformational behaviour of salmon calcitonin bound to sodium dodecyl sulfate micelles by means of restrained molecular dynamics simulations with both ‘static’ and time-averagen NMR distance restraints. A more realistic picture of the inherent flexibility of the hormone is obtained when using time averaging. With this apprach. long-range NOEs are interpreted better considering a dynamical exchange among different conformations.
Type of Medium:
Electronic Resource
URL:
http://dx.doi.org/10.1007/BF01874812
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