> dipolar couplings (NMR). But even then one should always look at the > structure model in the context of the experimental data. High
Is there an easy way to do this for NMR data? For x-ray data, it's relatively straightforward to re-calculate a map using the deposited model and amplitudes, which generally makes pretty clear which regions of the model may have issues. But from my conversations with NMR people there isn't an analogous process for NMR, short of re-refining against the constraints (of course, it's possible that I was/am asking the wrong question here). Pete
