解像度: 2.02→35.59 Å / Cor.coef. Fo:Fc: 0.955 / Cor.coef. Fo:Fc free: 0.922 / SU B: 3.734 / SU ML: 0.102 / 交差検証法: THROUGHOUT / ESU R: 0.173 / ESU R Free: 0.161 / 立体化学のターゲット値: MAXIMUM LIKELIHOOD 詳細: MN303 IS FOUND TO LIE ON THE 3-FOLD SYMMETRY AXIS. HYDROGENS HAVE BEEN USED IF PRESENT IN THE INPUT.
Rfactor
反射数
%反射
Selection details
Rfree
0.23957
823
5.1 %
RANDOM
Rwork
0.1952
-
-
-
obs
0.19738
15436
-
-
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