解像度: 2.011→57.89 Å / Cor.coef. Fo:Fc: 0.939 / Cor.coef. Fo:Fc free: 0.929 / SU R Cruickshank DPI: 0.162 / 交差検証法: THROUGHOUT / SU R Blow DPI: 0.163 / SU Rfree Blow DPI: 0.138 / SU Rfree Cruickshank DPI: 0.138
Rfactor
反射数
%反射
Selection details
Rfree
0.1947
2731
-
RANDOM
Rwork
0.1649
-
-
-
obs
0.1664
56902
92 %
-
原子変位パラメータ
Biso mean: 35.27 Å2
Baniso -1
Baniso -2
Baniso -3
1-
8.4396 Å2
-1.5601 Å2
1.0182 Å2
2-
-
-0.6847 Å2
6.1894 Å2
3-
-
-
-7.7549 Å2
Refine analyze
Luzzati coordinate error obs: 0.21 Å
精密化ステップ
サイクル: LAST / 解像度: 2.011→57.89 Å
タンパク質
核酸
リガンド
溶媒
全体
原子数
6109
0
146
489
6744
拘束条件
Refine-ID
タイプ
Dev ideal
数
Restraint function
Weight
X-RAY DIFFRACTION
t_bond_d
0.008
6485
HARMONIC
2
X-RAY DIFFRACTION
t_angle_deg
0.92
8878
HARMONIC
2
X-RAY DIFFRACTION
t_dihedral_angle_d
2121
SINUSOIDAL
2
X-RAY DIFFRACTION
t_gen_planes
1094
HARMONIC
5
X-RAY DIFFRACTION
t_it
6485
HARMONIC
10
X-RAY DIFFRACTION
t_chiral_improper_torsion
861
SEMIHARMONIC
5
X-RAY DIFFRACTION
t_ideal_dist_contact
5625
SEMIHARMONIC
4
X-RAY DIFFRACTION
t_omega_torsion
3.72
X-RAY DIFFRACTION
t_other_torsion
14.36
LS精密化 シェル
解像度: 2.011→2.02 Å
Rfactor
反射数
%反射
Rfree
0.2215
54
-
Rwork
0.2071
-
-
obs
-
-
90.03 %
精密化 TLS
Origin x: -26.3176 Å / Origin y: 25.5362 Å / Origin z: -21.4427 Å