解像度: 2.55→41.98 Å / Cor.coef. Fo:Fc: 0.955 / Cor.coef. Fo:Fc free: 0.937 / WRfactor Rfree: 0.2128 / WRfactor Rwork: 0.1878 / FOM work R set: 0.7858 / SU B: 30.298 / SU ML: 0.27 / SU R Cruickshank DPI: 0.2849 / SU Rfree: 0.3283 / 交差検証法: THROUGHOUT / σ(F): 0 / ESU R Free: 0.328 / 立体化学のターゲット値: MAXIMUM LIKELIHOOD / 詳細: HYDROGENS HAVE BEEN ADDED IN THE RIDING POSITIONS
Rfactor
反射数
%反射
Selection details
Rfree
0.2334
199
5.2 %
RANDOM
Rwork
0.2005
-
-
-
obs
0.2023
3663
97.06 %
-
溶媒の処理
イオンプローブ半径: 0.8 Å / 減衰半径: 0.8 Å / VDWプローブ半径: 1.2 Å / 溶媒モデル: MASK