A: Hypothetical nigD-like protein B: Hypothetical nigD-like protein C: Hypothetical nigD-like protein D: Hypothetical nigD-like protein E: Hypothetical nigD-like protein F: Hypothetical nigD-like protein G: Hypothetical nigD-like protein H: Hypothetical nigD-like protein I: Hypothetical nigD-like protein J: Hypothetical nigD-like protein K: Hypothetical nigD-like protein L: Hypothetical nigD-like protein ヘテロ分子
THE CONSTRUCT (RESIDUES 23-235) WAS EXPRESSED WITH A PURIFICATION TAG MGSDKIHHHHHHENLYFQG. THE TAG ...THE CONSTRUCT (RESIDUES 23-235) WAS EXPRESSED WITH A PURIFICATION TAG MGSDKIHHHHHHENLYFQG. THE TAG WAS REMOVED WITH TEV PROTEASE LEAVING ONLY A GLYCINE (0) FOLLOWED BY THE TARGET SEQUENCE.
解像度: 2.42→29.712 Å / Num. all: 121998 / Num. obs: 121998 / % possible obs: 99.9 % / 冗長度: 4.3 % / Rsym value: 0.096 / Net I/σ(I): 9.8
反射 シェル
Diffraction-ID: 1
解像度 (Å)
冗長度 (%)
Rmerge(I) obs
Mean I/σ(I) obs
Num. measured all
Num. unique all
Rsym value
% possible all
2.42-2.48
4.2
0.779
1
38299
9058
0.779
100
2.48-2.55
4.2
0.636
1.2
37390
8824
0.636
100
2.55-2.62
4.2
0.51
1.5
36109
8533
0.51
100
2.62-2.71
4.2
0.403
1.9
35350
8336
0.403
100
2.71-2.79
4.2
0.329
2.3
34048
8022
0.329
100
2.79-2.89
4.2
0.268
2.8
33033
7773
0.268
100
2.89-3
4.3
0.204
3.7
32265
7583
0.204
100
3-3.12
4.3
0.177
4.3
30670
7199
0.177
100
3.12-3.26
4.3
0.131
5.7
29537
6916
0.131
100
3.26-3.42
4.3
0.099
7.3
28365
6656
0.099
100
3.42-3.61
4.3
0.088
7.9
27017
6327
0.088
100
3.61-3.83
4.3
0.077
8.8
25357
5936
0.077
100
3.83-4.09
4.3
0.065
10.2
24128
5631
0.065
100
4.09-4.42
4.3
0.056
11.5
22334
5210
0.056
100
4.42-4.84
4.3
0.05
12.9
20487
4780
0.05
100
4.84-5.41
4.3
0.054
11.6
18701
4358
0.054
100
5.41-6.25
4.3
0.063
10.6
16402
3821
0.063
100
6.25-7.65
4.3
0.068
9.3
13848
3223
0.068
100
7.65-10.82
4.3
0.052
10
10729
2506
0.052
100
10.82-29.712
4.2
0.043
10.7
5509
1306
0.043
95.4
-
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
MolProbity
3beta29
モデル構築
PDB_EXTRACT
3.1
データ抽出
SOLVE
位相決定
SCALA
3.3.15
データスケーリング
BUSTER-TNT
2.8.0
精密化
MOSFLM
データ削減
BUSTER
2.8.0
精密化
精密化
構造決定の手法: 多波長異常分散 / 解像度: 2.42→29.712 Å / Cor.coef. Fo:Fc: 0.9393 / Cor.coef. Fo:Fc free: 0.9259 / Occupancy max: 1 / Occupancy min: 0.5 / 交差検証法: THROUGHOUT / σ(F): 0 詳細: 1. 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 0.75 FOR THE REDUCED ...詳細: 1. 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 0.75 FOR THE REDUCED SCATTERING POWER DUE TO PARTIAL S-MET INCORPORATION. 2. ATOM RECORD CONTAINS SUM OF TLS AND RESIDUAL B FACTORS. ANISOU RECORD CONTAINS SUM OF TLS AND RESIDUAL U FACTORS. 3. WATERS WERE EXCLUDED FROM AUTOMATIC TLS ASSIGNMENT. 4. CHLORIDE (CL) AND ETHYLENE GLYCOL (EDO) MODELED ARE PRESENT PROTEIN BUFFER. 5. NCS RESTRAINTS WERE APPLIED USING BUSTER'S LSSR RESTRAINT REPRESENTATION (-AUTONCS).