4IPX
Analyzing the visible conformational substates of the FK506 binding protein FKBP12
Experimental procedure
実験手法 | SINGLE WAVELENGTH |
Source type | ROTATING ANODE |
Source details | Cu FINE FOCUS |
Temperature [K] | 100 |
Detector technology | IMAGE PLATE |
Collection date | 2012-10-28 |
Detector | RIGAKU RAXIS IV++ |
Wavelength(s) | 1.5418 |
Spacegroup name | C 1 2 1 |
格子定数 [Å] | 70.550, 35.948, 40.923 |
格子定数 [度] | 90.00, 95.89, 90.00 |
精密化法
残基 | 19.607 - 1.700 |
R因子 | 0.2072 |
Rwork | 0.207 |
R-free | 0.21750 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 2ppn |
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] | 1.111 |
Data reduction software | CrystalClear |
Data scaling software | CrystalClear |
Phasing software | PHENIX |
Refinement software | PHENIX ((phenix.refine: 1.7.3_928)) |
Quality characteristics
Overall | Outer shell | |
分解能 [Å] (低) | 35.000 | 1.760 |
分解能 [Å] (高) | 1.700 | 1.700 |
Rmerge_l_obs | 0.097 | 0.296 |
独立反射数 | 10996 | |
<I/σ(I)> | 29.4 | 6.3 |
完全性 [%] | 93.7 | 93.6 |
冗長性 | 3.23 | 3.4 |
結晶化条件
結晶ID | 方法 | pH | 温度 | 溶液条件 |
1 | VAPOR DIFFUSION, HANGING DROP | 7.4 | 298 | 1.7 M sodium malonate, pH 7.0, 0.1 M HEPES, pH 7.4, 5% MPD, VAPOR DIFFUSION, HANGING DROP, temperature 298K |