解像度: 1.758→28.76 Å / Cor.coef. Fo:Fc: 0.952 / Cor.coef. Fo:Fc free: 0.925 / SU B: 2.815 / SU ML: 0.087 / 交差検証法: THROUGHOUT / ESU R: 0.144 / ESU R Free: 0.139 / 詳細: Hydrogens have been added in their riding positions
Rfactor
反射数
%反射
Selection details
Rfree
0.2399
980
-
RANDOM
Rwork
0.1918
18418
-
-
all
0.194
-
-
-
obs
-
19398
96.111 %
-
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
原子変位パラメータ
Biso mean: 15.631 Å2
Baniso -1
Baniso -2
Baniso -3
1-
0.521 Å2
0 Å2
-0 Å2
2-
-
0.28 Å2
0 Å2
3-
-
-
-0.801 Å2
精密化ステップ
サイクル: LAST / 解像度: 1.758→28.76 Å
タンパク質
核酸
リガンド
溶媒
全体
原子数
1676
0
14
181
1871
拘束条件
Refine-ID
タイプ
Dev ideal
Dev ideal target
数
X-RAY DIFFRACTION
r_bond_refined_d
0.019
0.019
1724
X-RAY DIFFRACTION
r_bond_other_d
0.002
0.02
1594
X-RAY DIFFRACTION
r_angle_refined_deg
1.916
1.949
2346
X-RAY DIFFRACTION
r_angle_other_deg
1.044
3
3654
X-RAY DIFFRACTION
r_dihedral_angle_1_deg
6.119
5
212
X-RAY DIFFRACTION
r_dihedral_angle_2_deg
39.424
25.581
86
X-RAY DIFFRACTION
r_dihedral_angle_3_deg
13.195
15
268
X-RAY DIFFRACTION
r_dihedral_angle_4_deg
20.183
15
6
X-RAY DIFFRACTION
r_chiral_restr
0.121
0.2
260
X-RAY DIFFRACTION
r_gen_planes_refined
0.01
0.02
2020
X-RAY DIFFRACTION
r_gen_planes_other
0.002
0.02
410
X-RAY DIFFRACTION
r_nbd_refined
0.256
0.2
834
X-RAY DIFFRACTION
r_symmetry_nbd_other
0.17
0.2
3022
X-RAY DIFFRACTION
r_nbtor_refined
0.173
0.2
1698
X-RAY DIFFRACTION
r_symmetry_nbtor_other
0.081
0.2
1882
X-RAY DIFFRACTION
r_xyhbond_nbd_refined
0.132
0.2
94
X-RAY DIFFRACTION
r_symmetry_nbd_refined
0.251
0.2
65
X-RAY DIFFRACTION
r_nbd_other
0.238
0.2
72
X-RAY DIFFRACTION
r_symmetry_xyhbond_nbd_refined
0.129
0.2
7
X-RAY DIFFRACTION
r_mcbond_it
1.122
1.324
854
X-RAY DIFFRACTION
r_mcbond_other
1.121
1.324
853
X-RAY DIFFRACTION
r_mcangle_it
1.542
1.98
1064
X-RAY DIFFRACTION
r_mcangle_other
1.542
1.98
1065
X-RAY DIFFRACTION
r_scbond_it
2.504
1.658
869
X-RAY DIFFRACTION
r_scbond_other
2.484
1.653
867
X-RAY DIFFRACTION
r_scangle_it
3.804
2.373
1282
X-RAY DIFFRACTION
r_scangle_other
3.804
2.373
1282
X-RAY DIFFRACTION
r_lrange_it
5.114
11.935
1953
X-RAY DIFFRACTION
r_lrange_other
5.077
11.932
1952
LS精密化 シェル
Refine-ID: X-RAY DIFFRACTION / Total num. of bins used: 20