* If the magnetic field independent value should be stored somewhere
else. I
guess that Edward has already discussed this before in some post..?
Any idea / comment ?
I have only recently noticed this problem with the scanning of the
entire BMRB. But I think we need a tag identifying the frequency of
the Rex data in the Order_parameter saveframe. For example:
_Order_parameter_list.Rex_frequency_1H
This is modelled on the
_Auto_relaxation_list.Spectrometer_frequency_1H tag. Alternatively
the Rex values could be the sigma_Rex field strength independent
value, though none of the current data is in this notation.
I would suggest that the values are stored as both field dependent Rex and
field independent sigma_Rex. The former would be useful for human perception
and comparison with the amplitude of the R2 data, and should definitely be
associated to a magnetic field (!). The latter would be better for direct
comparison between different systems / proteins...
Then we could have the new tags:
_Order_parameter_list.Rex_frequency_1H
_Order_param.Sigma_rex_val
_Order_param.Sigma_rex_val_fit_err
And keep the old tags:
_Order_param.Rex_val
_Order_param.Rex_val_fit_err
These 5 should cover everything.
Regards,
Edward