4KHR
HCV NS5B GT1A C316Y with GSK5852
Experimental procedure
| 実験手法 | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | CLSI BEAMLINE 08ID-1 |
| Synchrotron site | CLSI |
| Beamline | 08ID-1 |
| Temperature [K] | 100 |
| Detector technology | CCD |
| Collection date | 2011-09-27 |
| Detector | RAYONIX MX300HE |
| Wavelength(s) | 0.97949 |
| Spacegroup name | P 1 |
| 格子定数 [Å] | 53.353, 60.740, 91.985 |
| 格子定数 [度] | 89.32, 86.64, 80.32 |
精密化法
| 残基 | 29.940 - 2.450 |
| R因子 | 0.21 |
| Rwork | 0.208 |
| R-free | 0.24600 |
| Structure solution method | MOLECULAR REPLACEMENT |
| 結合長の平均二乗偏差(RMSD) [Å] | 0.008 |
| 結合角の平均二乗偏差(RMSD) [度] | 1.120 |
| Data reduction software | DENZO |
| Data scaling software | SCALEPACK |
| Phasing software | MOLREP |
| Refinement software | REFMAC |
Quality characteristics
| Overall | Outer shell | |
| 分解能 [Å] (低) | 50.000 | 2.410 |
| 分解能 [Å] (高) | 2.330 | 2.330 |
| Rmerge_l_obs | 0.148 | 0.584 |
| 独立反射数 | 48178 | |
| <I/σ(I)> | 4.6 | |
| 完全性 [%] | 98.5 | 97.6 |
| 冗長性 | 3.9 | 3.7 |
結晶化条件
| 結晶ID | 方法 | pH | 温度 | 溶液条件 |
| 1 | 5 | 298 | 0.1M Hepes pH7.5, 14% PEG6000, 0.2M ammonium sulfate, 10% glycerol, pH 5.0, vapor diffusion, hanging drop, temperature 298K |
