Dear all, I am refining a protein with PCS and RDCs from muliple lanthanides bound to my protein. I incorporated PCS using the python module and refine.py and I get the best results letting the tensor vary during the calculations. I would like to incorporate RDCs in the same way, letting the tensors vary during the calculations. However, I do not have many RDCs due to the broadening from each lanthanide. I would therefore like to link the RDCs to the tensors being calculated for the PCS since it is the same tensor for RDCs and PCS collected for the same metal. I am wondering if there is a way to do this using the python module and refine.py? Any help would be much appreciated.
Best, Taylor Cole -- Taylor Cole Graduate Student Dr. Tatyana Igumenova Lab Biochemistry & Biophysics Texas A&M University [email protected] (979)845-6313 _______________________________________________ Xplor-nih mailing list [email protected] https://dcb.cit.nih.gov/mailman/listinfo/xplor-nih
