温度: 291 K / 手法: 蒸気拡散法 / pH: 8.5 詳細: 0.01 M inhibitor, 0.01 M magnesium chloride, 0.01 M ATP were added to the protein sample. 30% PEG4000, 0.2M magnesium chloride, 0.1M Tris hydrochloride, pH 8.5, vapor diffusion, temperature 291K
解像度: 1.42→35 Å / Cor.coef. Fo:Fc: 0.97 / Cor.coef. Fo:Fc free: 0.963 / WRfactor Rfree: 0.205 / WRfactor Rwork: 0.181 / Occupancy max: 1 / Occupancy min: 0.3 / SU B: 1.912 / SU ML: 0.039 / 交差検証法: THROUGHOUT / σ(F): 0 / ESU R: 0.06 / ESU R Free: 0.061 / 立体化学のターゲット値: MAXIMUM LIKELIHOOD 詳細: GEOMETRY RESTRAINTS FOR THE INHIBITOR WERE CALCULATED BY PRODRG, AND MODIFIED BASED ON DATA IN THE CAMBRIDGE STRUCTURAL DATABASE. COOT WAS USED FOR MODEL BUILDING. THE MOLPROBITY SERVER WAS ...詳細: GEOMETRY RESTRAINTS FOR THE INHIBITOR WERE CALCULATED BY PRODRG, AND MODIFIED BASED ON DATA IN THE CAMBRIDGE STRUCTURAL DATABASE. COOT WAS USED FOR MODEL BUILDING. THE MOLPROBITY SERVER WAS USED FOR MODEL GEOMETRY VALIDATION.
Rfactor
反射数
%反射
Selection details
Rfree
0.1942
2711
5.086 %
RANDOM
Rwork
0.1713
-
-
-
obs
0.172
53298
97.882 %
-
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 BULK SOLVENT