2A4G
Hepatitis C Protease NS3-4A serine protease with Ketoamide Inhibitor SCH225724 Bound
Experimental procedure
実験手法 | SINGLE WAVELENGTH |
Detector technology | IMAGE PLATE |
Collection date | 1999-04-08 |
Detector | RIGAKU RAXIS IV |
Spacegroup name | H 3 2 |
格子定数 [Å] | 224.392, 224.392, 75.334 |
格子定数 [度] | 90.00, 90.00, 120.00 |
精密化法
残基 | 8.000 - 2.500 |
Rwork | 0.193 |
R-free | 0.26500 |
Structure solution method | FOURIER SYNTHESIS |
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] | 1.850 |
Data reduction software | HKL-2000 |
Data scaling software | SCALEPACK |
Phasing software | X-PLOR |
Refinement software | X-PLOR (98.1) |
Quality characteristics
Overall | Outer shell | |
分解能 [Å] (低) | 50.000 | 2.590 |
分解能 [Å] (高) | 2.500 | 2.500 |
Rmerge_l_obs | 0.031 | |
独立反射数 | 27752 | |
<I/σ(I)> | 17.7 | |
完全性 [%] | 99.5 | 99.5 |
冗長性 | 3.4 | 3.4 |
結晶化条件
結晶ID | 方法 | pH | 温度 | 溶液条件 |
1 | VAPOR DIFFUSION, HANGING DROP | 5.5 | 285 | MES, sodium potassium phosphate, sodium chloride, 2-mercaptoethanol, pH 5.5, VAPOR DIFFUSION, HANGING DROP, temperature 285K |