We study the inverse problem of determining the position of the moving C-terminal domain in a metalloprotein from measurements of its mean paramagnetic tensor $\bar\chi$. The latter can be represented as a finite sum involving the corresponding magnetic susceptibility tensor $\chi$ and a finite number of rotations. We obtain an optimal estimate for the maximum probability that the C-terminal domain can assume a given orientation, and we show that only three rotations are required in the representation of $\bar\chi$, and that in general two are not enough.

Reconstruction of orientations of a moving protein domain from paramagnetic data

Sgheri L
2005

Abstract

We study the inverse problem of determining the position of the moving C-terminal domain in a metalloprotein from measurements of its mean paramagnetic tensor $\bar\chi$. The latter can be represented as a finite sum involving the corresponding magnetic susceptibility tensor $\chi$ and a finite number of rotations. We obtain an optimal estimate for the maximum probability that the C-terminal domain can assume a given orientation, and we show that only three rotations are required in the representation of $\bar\chi$, and that in general two are not enough.
2005
Istituto Applicazioni del Calcolo ''Mauro Picone''
inverse problems
protein folding
NMR spectroscopy
RDC
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Utilizza questo identificativo per citare o creare un link a questo documento: https://hdl.handle.net/20.500.14243/161664
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