1PW2
APO STRUCTURE OF HUMAN CYCLIN-DEPENDENT KINASE 2
Experimental procedure
実験手法 | SINGLE WAVELENGTH |
Source type | ROTATING ANODE |
Source details | ENRAF-NONIUS FR571 |
Temperature [K] | 100 |
Detector technology | IMAGE PLATE |
Collection date | 2001-09-01 |
Detector | MARRESEARCH |
Wavelength(s) | 1.54 |
Spacegroup name | P 21 21 21 |
格子定数 [Å] | 53.687, 71.799, 72.032 |
格子定数 [度] | 90.00, 90.00, 90.00 |
精密化法
残基 | 19.930 - 1.950 |
R因子 | 0.213 |
Rwork | 0.213 |
R-free | 0.24900 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 1hcl |
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] | 22.600 * |
Data reduction software | DENZO |
Data scaling software | SCALEPACK |
Phasing software | MOLREP |
Refinement software | CNS (1.0) |
Quality characteristics
Overall | Outer shell | |
分解能 [Å] (低) | 20.000 | 2.000 |
分解能 [Å] (高) | 1.950 | 1.950 |
Rmerge_l_obs | 0.073 | 0.235 * |
Total number of observations | 222716 * | |
独立反射数 | 20576 | |
<I/σ(I)> | 16.5 | |
完全性 [%] | 97.1 * | 98.4 * |
冗長性 | 10.45 |
結晶化条件
結晶ID | 方法 | pH | 温度 | 溶液条件 |
1 | VAPOR DIFFUSION, HANGING DROP | 7.8 | 277 | PEG 6000, Na-HEPES, pH 7.8, VAPOR DIFFUSION, HANGING DROP, temperature 277K |
文献の結晶化試薬
ID | 結晶ID | 溶液 | 試薬名 | 濃度 (単位) (単位) | 詳細 |
1 | 1 | drop | protein | 7-8 (mg/ml) | |
2 | 1 | reservoir | PEG6000 | 15 (%) | |
3 | 1 | reservoir | sodium HEPES | 100 (mM) | pH7.8-8.2 |