6QRT
X-ray radiation dose series on xylose isomerase - 1.38 MGy
Experimental procedure
| 実験手法 | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | SSRL BEAMLINE BL11-1 |
| Synchrotron site | SSRL |
| Beamline | BL11-1 |
| Temperature [K] | 100 |
| Detector technology | CCD |
| Collection date | 2004-05-01 |
| Detector | ADSC QUANTUM 315 |
| Wavelength(s) | 0.954, 0.855 |
| Spacegroup name | I 2 2 2 |
| 格子定数 [Å] | 92.523, 97.518, 102.522 |
| 格子定数 [度] | 90.00, 90.00, 90.00 |
精密化法
| 残基 | 35.329 - 1.170 |
| R因子 | 0.1002 |
| R-free | 0.11810 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 6qrr |
| 結合長の平均二乗偏差(RMSD) [Å] | 0.009 |
| 結合角の平均二乗偏差(RMSD) [度] | 1.168 |
| Data reduction software | XDS |
| Data scaling software | Aimless |
| Refinement software | PHENIX ((1.14_3247: ???)) |
Quality characteristics
| Overall | Outer shell | |
| 分解能 [Å] (低) | 38.700 | 1.190 |
| 分解能 [Å] (高) | 1.170 | 1.170 |
| Rmeas | 0.087 | 0.476 |
| 独立反射数 | 154212 | |
| <I/σ(I)> | 11.3 | |
| 完全性 [%] | 99.4 | |
| 冗長性 | 3.5 |
結晶化条件
| 結晶ID | 方法 | pH | 温度 | 溶液条件 |
| 1 | VAPOR DIFFUSION, HANGING DROP | 295.15 | 2-propanol, ethylene glycol, HEPES, magnesium chloride |
