PanDDA analysis group deposition of models of ground state datasets
タイプ
ground state
解説
bromodomain of human BAZ2B screened against the ZENOBIA Fragment Library by X-ray Crystallography at the XChem facility of Diamond Light Source beamline I04-1. Check out the PanDDA event maps at https://zenodo.org/record/290199/files/0_index.html
解像度: 1.69→29 Å / Cor.coef. Fo:Fc: 0.964 / Cor.coef. Fo:Fc free: 0.952 / SU B: 1.987 / SU ML: 0.062 / 交差検証法: THROUGHOUT / σ(F): 0 / ESU R: 0.077 / ESU R Free: 0.081 / 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
0.2152
1291
5 %
RANDOM
Rwork
0.1851
-
-
-
obs
0.1866
24547
98.82 %
-
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: MASK