Resolution: 2.71→20 Å / Cor.coef. Fo:Fc: 0.908 / Cor.coef. Fo:Fc free: 0.864 / SU B: 11.596 / SU ML: 0.238 / Cross valid method: THROUGHOUT / ESU R: 0.442 / ESU R Free: 0.338 / Stereochemistry target values: MAXIMUM LIKELIHOOD / Details: HYDROGENS HAVE BEEN ADDED IN THE RIDING POSITIONS
Rfactor
Num. reflection
% reflection
Selection details
Rfree
0.32705
170
4.5 %
RANDOM
Rwork
0.28462
-
-
-
obs
0.28669
3632
97.61 %
-
Solvent computation
Ion probe radii: 0.8 Å / Shrinkage radii: 0.8 Å / VDW probe radii: 1.2 Å / Solvent model: MASK