Re: [phenixbb] large coordinate and map shift after simulated annealing

Hi Ralf, Thank you so much! What's the meaning of polar axis? For one structure, the space group is P1. For the other one, the space group is C2. Do they have polar axis? Fengyun 引用 "Ralf W. Grosse-Kunstleve" ：

Hi Fengyun,

Do you have a space group with a "polar axis"? For example P21? If that's the case the shift is inconsequential: shifting the entire structure arbitrarily along a polar axis does not change the calculated structure factor amplitudes. I.e. I think you don't have to worry about the shift.

Ralf _______________________________________________ phenixbb mailing list [email protected] http://phenix-online.org/mailman/listinfo/phenixbb