Residue-specific fitting 13C MQ CPMG #210
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Hello! I am currently trying to use ChemEx to fit 13C MQ CPMG data that was acquired at 600 MHz and I would like to know if it is possible to fit each residue individually instead of using a global fit. If so, how would you do this? Thank you! |
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Answered by
gbouvignies
Mar 20, 2024
Replies: 1 comment
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Hello, For individual residue fits using a two-state model in ChemEx, utilize the model "2st_rs". Include the option chemex fit -e [...] -d 2st_rsThis configuration allows for residue-specific global exchange parameters. |
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gbouvignies
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Hello,
For individual residue fits using a two-state model in ChemEx, utilize the model "2st_rs". Include the option
-d 2st_rsin your command:This configuration allows for residue-specific global exchange parameters.