1EVG
CRYSTAL STRUCTURE ANALYSIS OF CYS167 MUTANT OF ESCHERICHIA COLI WITH UNMODIFIED CATALYTIC CYSTEINE
Experimental procedure
実験手法 | SINGLE WAVELENGTH |
Source type | ROTATING ANODE |
Source details | RIGAKU RU200 |
Temperature [K] | 95 |
Detector technology | IMAGE PLATE |
Collection date | 1998-11-25 |
Detector | RIGAKU RAXIS |
Spacegroup name | I 21 3 |
格子定数 [Å] | 131.973, 131.973, 131.973 |
格子定数 [度] | 90.00, 90.00, 90.00 |
精密化法
残基 | 6.000 - 2.000 |
R因子 | 0.212 |
Rwork | 0.212 |
R-free | 0.22500 |
結合長の平均二乗偏差(RMSD) [Å] | 0.006 |
結合角の平均二乗偏差(RMSD) [度] | 24.000 * |
Data scaling software | SCALEPACK |
Phasing software | AMoRE |
Refinement software | CNS (0.5) |
Quality characteristics
Overall | Outer shell | |
分解能 [Å] (低) | 6.000 | 2.070 |
分解能 [Å] (高) | 2.000 | 2.000 |
Rmerge_l_obs | 0.083 | 0.214 |
独立反射数 | 24936 | |
<I/σ(I)> | 25.79 | |
完全性 [%] | 100.0 | 99.6 |
冗長性 | 10.9 |
結晶化条件
結晶ID | 方法 | pH | 温度 | 溶液条件 |
1 | VAPOR DIFFUSION, HANGING DROP | 7.5 * | 291 | 48% saturated ammonium sulfate, 100 mM Tris HCl, 20 mM 2-mercaptoethanol , pH 7.8, VAPOR DIFFUSION, HANGING DROP, temperature 18K |
文献の結晶化試薬
ID | 結晶ID | 溶液 | 試薬名 | 濃度 (単位) (単位) | 詳細 |
1 | 1 | drop | enzyme | 7-10 (mg/ml) | |
2 | 1 | drop | EDTA | 1 (mM) | |
3 | 1 | drop | 2-mercaptoethanol | 15 (mM) | |
4 | 1 | drop | potassium chloride | 50-100 (mM) | |
5 | 1 | drop | potassium phosphate | 20-50 (mM) | |
6 | 1 | reservoir | ammonium sulfate | 48 (%sat) | |
7 | 1 | reservoir | 2-mercaptoethanol | 20 (mM) | |
8 | 1 | reservoir | Tris-HCl | 100 (mM) |