[phenixbb] tls refinement

[sbiswas2 at ncsu.edu]

Hi all,

I started doing TLS refinement with one of my structures and got the
following:
Start R-work = 0.3817, R-free = 0.3923 (no bulk solvent and anisotropic
scale)
Final R-work = 0.3788, R-free = 0.3885 (no bulk solvent and anisotropic
scale)

Start R-work = 0.2094, R-free = 0.2381
Final R-work = 0.2058, R-free = 0.2358

my question now is why is the R value high without the anisotropic scale?
Second question is:
can I refine alternate conformations using the command line or is it
already there in the default parameters?
Thanks,
Shya
NC State University