Resolution: 3.4→48.79 Å / Cor.coef. Fo:Fc: 0.929 / Cor.coef. Fo:Fc free: 0.849 / SU B: 18.758 / SU ML: 0.312 / Cross valid method: THROUGHOUT / ESU R Free: 0.117 / Stereochemistry target values: MAXIMUM LIKELIHOOD Details: HYDROGENS HAVE BEEN ADDED IN THE RIDING POSITIONS. U VALUES REFINED INDIVIDUALLY
Rfactor
Num. reflection
% reflection
Selection details
Rfree
0.22927
346
4.7 %
RANDOM
Rwork
0.16478
-
-
-
obs
0.16794
6946
95.63 %
-
Solvent computation
Ion probe radii: 0.8 Å / Shrinkage radii: 0.8 Å / VDW probe radii: 1.2 Å / Solvent model: MASK