BIOMOLECULE: 1 THIS ENTRY CONTAINS THE CRYSTALLOGRAPHIC ASYMMETRIC UNIT WHICH CONSISTS OF 4 CHAIN(S) ...BIOMOLECULE: 1 THIS ENTRY CONTAINS THE CRYSTALLOGRAPHIC ASYMMETRIC UNIT WHICH CONSISTS OF 4 CHAIN(S). SEE REMARK 350 FOR INFORMATION ON GENERATING THE BIOLOGICAL MOLECULE(S). SIZE EXCLUSION CHROMATOGRAPHY WITH STATIC LIGHT SCATTERING SUPPORTS THE ASSIGNMENT OF A TETRAMER AS THE BIOLOGICALLY RELEVANT OLIGIMERIZATION STATE.
解像度: 2.1→29.93 Å / Num. obs: 100112 / % possible obs: 98 % / 冗長度: 3.4 % / Rmerge(I) obs: 0.048 / Rsym value: 0.048 / Net I/σ(I): 10.6
反射 シェル
Diffraction-ID: 1
解像度 (Å)
% possible obs (%)
冗長度 (%)
Rmerge(I) obs
Mean I/σ(I) obs
Num. measured obs
Rsym value
2.1-2.21
88.6
2.7
0.413
1.9
12939
0.413
2.21-2.35
99.5
3.4
0.271
2.8
13922
0.271
2.35-2.51
99.9
3.6
0.179
4.3
13156
0.179
2.51-2.71
100
3.6
0.121
6.3
12307
0.121
2.71-2.97
99.9
3.6
0.074
9.9
11310
0.074
2.97-3.32
99.8
3.6
0.05
13.4
10280
0.05
3.32-3.83
99.8
3.5
0.032
19.7
9081
0.032
3.83-4.7
99.6
3.5
0.032
17
7737
0.032
4.7-6.64
98.4
3.2
0.035
14.4
5954
0.035
6.64-29.93
98
3.4
0.022
22.5
3426
0.022
-
位相決定
位相決定
手法: 多波長異常分散
-
解析
ソフトウェア
名称
バージョン
分類
NB
REFMAC
5.2.0005
精密化
SCALA
データスケーリング
MOSFLM
データ削減
CCP4
(SCALA)
データスケーリング
SOLVE
位相決定
精密化
構造決定の手法: 多波長異常分散 / 解像度: 2.1→29.6 Å / Cor.coef. Fo:Fc: 0.971 / Cor.coef. Fo:Fc free: 0.962 / SU B: 5.928 / SU ML: 0.078 / TLS residual ADP flag: LIKELY RESIDUAL / 交差検証法: THROUGHOUT / ESU R: 0.113 / ESU R Free: 0.107 立体化学のターゲット値: MAXIMUM LIKELIHOOD WITH PHASES 詳細: 1. HYDROGENS HAVE BEEN ADDED IN THE RIDING POSITIONS. 2. X-RAY FLUORESCENCE SUPPORTS THE ASSIGNMENT OF THE METAL SITES AS NICKEL. 3. A MET-INHIBITION PROTOCOL WAS USED FOR SELENOMETHIONINE ...詳細: 1. HYDROGENS HAVE BEEN ADDED IN THE RIDING POSITIONS. 2. X-RAY FLUORESCENCE SUPPORTS THE ASSIGNMENT OF THE METAL SITES AS NICKEL. 3. A MET-INHIBITION PROTOCOL WAS USED FOR SELENOMETHIONINE INCORPORATION DURING PROTEIN EXPRESSION. THE OCCUPANCY OF THE SE ATOMS IN THE MSE RESIDUES WAS REDUCED TO 0.7 TO ACCOUNT FOR THE REDUCED SCATTERING POWER DUE TO PARTIAL S-MET INCORPORATION.
Rfactor
反射数
%反射
Selection details
Rfree
0.178
5004
5 %
RANDOM
Rwork
0.157
-
-
-
all
0.159
-
-
-
obs
0.15855
95035
97.81 %
-
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: BABINET MODEL WITH MASK