解像度: 2.4→21.56 Å / Cor.coef. Fo:Fc: 0.948 / Cor.coef. Fo:Fc free: 0.931 / SU B: 5.01 / SU ML: 0.122 / 交差検証法: THROUGHOUT / ESU R: 0.057 / ESU R Free: 0.048 / 立体化学のターゲット値: MAXIMUM LIKELIHOOD 詳細: HYDROGENS HAVE BEEN ADDED IN THE RIDING POSITIONS. U VALUES REFINED INDIVIDUALLY
Rfactor
反射数
%反射
Selection details
Rfree
0.27543
4258
5 %
RANDOM
Rwork
0.2467
-
-
-
obs
0.24817
80521
99.48 %
-
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