Resolution: 3.4→50 Å / Cor.coef. Fo:Fc: 0.923 / Cor.coef. Fo:Fc free: 0.864 / SU B: 16.191 / SU ML: 0.277 / Cross valid method: THROUGHOUT / ESU R Free: 0.133 Details: THE STRUCTURE WAS ORIGINALLY REFINED USING P61 2 2, THE R/RFREE VALUES WAS HIGH. THE STRUCTURE WAS THEN REFINED USING P21, THE R/RFREE VALUES WAS DECREASED DRAMATICALLY. HYDROGENS HAVE BEEN ...Details: THE STRUCTURE WAS ORIGINALLY REFINED USING P61 2 2, THE R/RFREE VALUES WAS HIGH. THE STRUCTURE WAS THEN REFINED USING P21, THE R/RFREE VALUES WAS DECREASED DRAMATICALLY. HYDROGENS HAVE BEEN ADDED IN THE RIDING POSITIONS.
Rfactor
Num. reflection
% reflection
Selection details
Rfree
0.25418
1494
4.7 %
RANDOM
Rwork
0.20273
-
-
-
obs
0.20498
30208
98.22 %
-
Solvent computation
Ion probe radii: 0.8 Å / Shrinkage radii: 0.8 Å / VDW probe radii: 1.2 Å