Experimental procedure
| 実験手法 | MAD |
| Source type | SYNCHROTRON |
| Source details | ALS BEAMLINE 8.2.1 |
| Synchrotron site | ALS |
| Beamline | 8.2.1 |
| Temperature [K] | 173 |
| Detector technology | CCD |
| Collection date | 2007-08-10 |
| Detector | ADSC QUANTUM 315 |
| Wavelength(s) | 0.97960, 0.95370, 0.97980 |
| Spacegroup name | C 1 2 1 |
| 格子定数 [Å] | 85.188, 71.718, 43.323 |
| 格子定数 [度] | 90.00, 104.59, 90.00 |
精密化法
| 残基 | 36.163 - 2.200 |
| R因子 | 0.161 |
| Rwork | 0.157 |
| R-free | 0.22800 |
| Structure solution method | MAD |
| 結合長の平均二乗偏差(RMSD) [Å] | 0.017 |
| 結合角の平均二乗偏差(RMSD) [度] | 1.310 |
| Data reduction software | DENZO |
| Data scaling software | SCALEPACK |
| Phasing software | SHELX |
| Refinement software | PHENIX |
Quality characteristics
| Overall | Outer shell | |
| 分解能 [Å] (低) | 40.000 | 2.280 |
| 分解能 [Å] (高) | 2.200 | 2.200 |
| Rmerge_l_obs | 0.051 | 0.228 |
| 独立反射数 | 12695 | |
| <I/σ(I)> | 46.3 | 5.1 |
| 完全性 [%] | 98.4 | 88.3 |
| 冗長性 | 7 |
結晶化条件
| 結晶ID | 方法 | pH | 温度 | 溶液条件 |
| 1 | VAPOR DIFFUSION, SITTING DROP | 4.5 | 293 | 35% 2-methyl-2,4-pentanediol, 0.1 M Sodium acetate pH 4.5, VAPOR DIFFUSION, SITTING DROP, temperature 293K |
