2OJG
Crystal structure of ERK2 in complex with N,N-dimethyl-4-(4-phenyl-1H-pyrazol-3-yl)-1H-pyrrole-2-carboxamide
Experimental procedure
実験手法 | SINGLE WAVELENGTH |
Source type | ROTATING ANODE |
Source details | RIGAKU |
Temperature [K] | 100 |
Detector technology | IMAGE PLATE |
Collection date | 1999-09-01 |
Detector | RIGAKU |
Spacegroup name | P 1 21 1 |
格子定数 [Å] | 48.665, 70.776, 60.141 |
格子定数 [度] | 90.00, 109.03, 90.00 |
精密化法
残基 | 19.970 - 2.000 |
R因子 | 0.22 |
Rwork | 0.216 |
R-free | 0.26000 |
Structure solution method | FOURIER SYNTHESIS |
結合長の平均二乗偏差(RMSD) [Å] | 0.005 |
結合角の平均二乗偏差(RMSD) [度] | 1.200 |
Data reduction software | DENZO |
Data scaling software | SCALEPACK |
Phasing software | CNX |
Refinement software | CNS |
Quality characteristics
Overall | |
分解能 [Å] (低) | 20.000 |
分解能 [Å] (高) | 2.000 |
Rmerge_l_obs | 0.048 |
独立反射数 | 23772 |
<I/σ(I)> | 14.8 |
完全性 [%] | 93.1 |
冗長性 | 2.77 |
結晶化条件
結晶ID | 方法 | pH | 温度 | 溶液条件 |
1 | VAPOR DIFFUSION | 7.2 | 298 | protein: 14 mg/ml, 20 mM Tris, pH 7.0, 5 mM DTT, 200 mM NaCl. precipitant: 100 mM HEPES, pH 7.2, 28-30% PEG-MME-2000, 200 mM Ammonium Sulfate, 20 mM 2-ME, VAPOR DIFFUSION, temperature 298K |