2BKS
crystal structure of Renin-PF00074777 complex
Experimental procedure
実験手法 | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | APS BEAMLINE 17-ID |
Synchrotron site | APS |
Beamline | 17-ID |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2003-07-09 |
Detector | ADSC CCD |
Spacegroup name | P 21 3 |
格子定数 [Å] | 141.916, 141.916, 141.916 |
格子定数 [度] | 90.00, 90.00, 90.00 |
精密化法
残基 | 25.000 - 2.200 |
R因子 | 0.2432 |
Rwork | 0.243 |
R-free | 0.28440 |
Structure solution method | MOLECULAR REPLACEMENT |
結合長の平均二乗偏差(RMSD) [Å] | 0.006 |
結合角の平均二乗偏差(RMSD) [度] | 1.390 |
Refinement software | CNS |
Quality characteristics
Overall | Outer shell | |
分解能 [Å] (低) | 50.000 | 2.280 |
分解能 [Å] (高) | 2.200 | 2.200 |
Rmerge_l_obs | 0.070 | 0.220 |
独立反射数 | 47471 | |
<I/σ(I)> | 39 | 6 |
完全性 [%] | 98.0 | 90 |
冗長性 | 13 | 7.1 |
結晶化条件
結晶ID | 方法 | pH | 温度 | 溶液条件 |
1 | 6 | pH 6.00 |