解像度: 1.6→30 Å / Cor.coef. Fo:Fc: 0.955 / Cor.coef. Fo:Fc free: 0.931 / SU B: 1.171 / SU ML: 0.043 / 交差検証法: THROUGHOUT / ESU R: 0.094 / ESU R Free: 0.105 / 立体化学のターゲット値: MAXIMUM LIKELIHOOD 詳細: HYDROGENS HAVE BEEN ADDED IN THE RIDING POSITIONS THE LAST REFINEMENT ROUND WAS DONE AGAINST ALL DATA, RFREE VALUES ARE THE LAST RECORDED
Rfactor
反射数
%反射
Selection details
Rfree
0.214
1575
10.1 %
RANDOM
Rwork
0.172
-
-
-
obs
0.174
15620
99.8 %
-
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: 1.4 Å / 溶媒モデル: BABINET MODEL WITH MASK