解像度: 2.7→79.387 Å / Cor.coef. Fo:Fc: 0.954 / Cor.coef. Fo:Fc free: 0.934 / SU B: 12.547 / SU ML: 0.243 / 交差検証法: THROUGHOUT / ESU R: 0.486 / ESU R Free: 0.283 / 詳細: Hydrogens have been added in their riding positions
Rfactor
反射数
%反射
Rfree
0.2346
5365
4.98 %
Rwork
0.1919
-
-
all
0.194
-
-
obs
-
107741
99.904 %
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
原子変位パラメータ
Biso mean: 69.301 Å2
Baniso -1
Baniso -2
Baniso -3
1-
1.288 Å2
0.644 Å2
0 Å2
2-
-
1.288 Å2
0 Å2
3-
-
-
-4.179 Å2
精密化ステップ
サイクル: LAST / 解像度: 2.7→79.387 Å
タンパク質
核酸
リガンド
溶媒
全体
原子数
19763
0
0
8
19771
拘束条件
Refine-ID
タイプ
Dev ideal
Dev ideal target
数
X-RAY DIFFRACTION
r_bond_refined_d
0.004
0.013
20156
X-RAY DIFFRACTION
r_bond_other_d
0.001
0.017
18666
X-RAY DIFFRACTION
r_angle_refined_deg
1.294
1.638
27330
X-RAY DIFFRACTION
r_angle_other_deg
1.143
1.571
43364
X-RAY DIFFRACTION
r_dihedral_angle_1_deg
6.734
5
2489
X-RAY DIFFRACTION
r_dihedral_angle_2_deg
34.834
23.134
1088
X-RAY DIFFRACTION
r_dihedral_angle_3_deg
16.431
15
3467
X-RAY DIFFRACTION
r_dihedral_angle_4_deg
15.804
15
124
X-RAY DIFFRACTION
r_chiral_restr
0.052
0.2
2594
X-RAY DIFFRACTION
r_gen_planes_refined
0.004
0.02
22564
X-RAY DIFFRACTION
r_gen_planes_other
0.001
0.02
4064
X-RAY DIFFRACTION
r_nbd_refined
0.193
0.2
4150
X-RAY DIFFRACTION
r_symmetry_nbd_other
0.176
0.2
17726
X-RAY DIFFRACTION
r_nbtor_refined
0.155
0.2
9568
X-RAY DIFFRACTION
r_symmetry_nbtor_other
0.076
0.2
9005
X-RAY DIFFRACTION
r_xyhbond_nbd_refined
0.141
0.2
386
X-RAY DIFFRACTION
r_symmetry_nbd_refined
0.117
0.2
31
X-RAY DIFFRACTION
r_nbd_other
0.164
0.2
108
X-RAY DIFFRACTION
r_symmetry_xyhbond_nbd_refined
0.122
0.2
8
X-RAY DIFFRACTION
r_mcbond_it
3.844
7.324
10016
X-RAY DIFFRACTION
r_mcbond_other
3.839
7.324
10015
X-RAY DIFFRACTION
r_mcangle_it
5.947
10.976
12485
X-RAY DIFFRACTION
r_mcangle_other
5.947
10.976
12486
X-RAY DIFFRACTION
r_scbond_it
3.583
7.63
10140
X-RAY DIFFRACTION
r_scbond_other
3.583
7.631
10141
X-RAY DIFFRACTION
r_scangle_it
5.703
11.305
14845
X-RAY DIFFRACTION
r_scangle_other
5.703
11.305
14846
X-RAY DIFFRACTION
r_lrange_it
8.262
84.75
21860
X-RAY DIFFRACTION
r_lrange_other
8.261
84.754
21860
LS精密化 シェル
Refine-ID: X-RAY DIFFRACTION / Total num. of bins used: 20