解像度: 2→42.37 Å / Cor.coef. Fo:Fc: 0.947 / Cor.coef. Fo:Fc free: 0.926 / WRfactor Rfree: 0.2182 / WRfactor Rwork: 0.1751 / Occupancy max: 1 / Occupancy min: 0.5 / FOM work R set: 0.8561 / SU B: 4.066 / SU ML: 0.115 / SU R Cruickshank DPI: 0.1801 / SU Rfree: 0.1641 / 交差検証法: THROUGHOUT / σ(F): 0 / ESU R: 0.18 / ESU R Free: 0.164 / 立体化学のターゲット値: MAXIMUM LIKELIHOOD 詳細: HYDROGENS HAVE BEEN USED IF PRESENT IN THE INPUT U VALUES: REFINED INDIVIDUALLY
Rfactor
反射数
%反射
Selection details
Rfree
0.2383
945
5.1 %
RANDOM
Rwork
0.1926
-
-
-
obs
0.195
18594
99.67 %
-
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