3GPG
Crystal structure of macro domain of Chikungunya virus
Experimental procedure
| 実験手法 | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | ESRF BEAMLINE ID14-2 |
| Synchrotron site | ESRF |
| Beamline | ID14-2 |
| Temperature [K] | 100 |
| Detector technology | CCD |
| Collection date | 2007-06-22 |
| Detector | ADSC QUANTUM 4 |
| Wavelength(s) | 0.9330 |
| Spacegroup name | P 31 |
| 格子定数 [Å] | 87.061, 87.061, 84.492 |
| 格子定数 [度] | 90.00, 90.00, 120.00 |
精密化法
| 残基 | 34.430 - 1.650 |
| R因子 | 0.167 |
| Rwork | 0.166 |
| R-free | 0.19600 |
| Structure solution method | SAD |
| 結合長の平均二乗偏差(RMSD) [Å] | 0.012 |
| 結合角の平均二乗偏差(RMSD) [度] | 1.337 |
| Data reduction software | MOSFLM |
| Data scaling software | SCALA |
| Phasing software | SHELX |
| Refinement software | REFMAC |
Quality characteristics
| Overall | Outer shell | |
| 分解能 [Å] (低) | 35.000 | 1.740 |
| 分解能 [Å] (高) | 1.650 | 1.650 |
| Rmerge_l_obs | 0.052 | 0.468 |
| 独立反射数 | 86209 | |
| <I/σ(I)> | 3.2 | |
| 完全性 [%] | 100.0 | 100 |
| 冗長性 | 5.7 | 5.7 |
結晶化条件
| 結晶ID | 方法 | pH | 温度 | 溶液条件 |
| 1 | VAPOR DIFFUSION, HANGING DROP | 7.4 | 293 | 46% PEG 600, 100 mM hepes, pH 7.4, VAPOR DIFFUSION, HANGING DROP, temperature 293K |
