Experimental procedure
| 実験手法 | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | ALS BEAMLINE 8.3.1 |
| Synchrotron site | ALS |
| Beamline | 8.3.1 |
| Temperature [K] | 291 |
| Detector technology | CCD |
| Collection date | 2013-10-03 |
| Detector | ADSC QUANTUM 315 |
| Wavelength(s) | 1.1 |
| Spacegroup name | P 21 21 21 |
| 格子定数 [Å] | 212.020, 434.570, 623.130 |
| 格子定数 [度] | 90.00, 90.00, 90.00 |
精密化法
| 残基 | 69.320 - 2.900 |
| R因子 | 0.186 |
| Rwork | 0.186 |
| R-free | 0.25500 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 4ybb |
| 結合長の平均二乗偏差(RMSD) [Å] | 0.013 |
| 結合角の平均二乗偏差(RMSD) [度] | 2.001 |
| Data reduction software | XDS |
| Data scaling software | XSCALE |
| Phasing software | PHENIX |
| Refinement software | PHENIX (1.11.1_2575) |
Quality characteristics
| Overall | Outer shell | |
| 分解能 [Å] (低) | 69.324 | 2.900 |
| 分解能 [Å] (高) | 2.800 | 2.800 |
| Rmerge_l_obs | 0.208 | 1.686 |
| 独立反射数 | 1077740 | |
| <I/σ(I)> | 6.71 | 0.23 |
| 完全性 [%] | 77.3 | 5.4 |
| 冗長性 | 6.39 | 1.03 |
結晶化条件
| 結晶ID | 方法 | pH | 温度 | 溶液条件 |
| 1 | MICROBATCH | 6.5 | 291 | PEG8k, MPD, KSCN |
| 1 | MICROBATCH | 6.5 | 291 | PEG8k, MPD, KSCN |
