2HHL
Crystal structure of the human small CTD phosphatase 3 isoform 1
Experimental procedure
実験手法 | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | NSLS BEAMLINE X6A |
Synchrotron site | NSLS |
Beamline | X6A |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2006-06-21 |
Detector | ADSC QUANTUM 4 |
Wavelength(s) | 1.74 |
Spacegroup name | P 1 21 1 |
格子定数 [Å] | 47.419, 49.857, 179.747 |
格子定数 [度] | 90.00, 96.90, 90.00 |
精密化法
残基 | 19.860 - 2.100 |
R因子 | 0.191 |
Rwork | 0.188 |
R-free | 0.25200 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 1ta0 |
結合長の平均二乗偏差(RMSD) [Å] | 0.022 |
結合角の平均二乗偏差(RMSD) [度] | 3.199 |
Data reduction software | DENZO |
Data scaling software | SCALEPACK |
Phasing software | MOLREP |
Refinement software | REFMAC (5.2.0005) |
Quality characteristics
Overall | Outer shell | |
分解能 [Å] (低) | 20.000 | 2.180 |
分解能 [Å] (高) | 2.100 | 2.100 |
Rmerge_l_obs | 0.056 | 0.265 |
独立反射数 | 47666 | |
<I/σ(I)> | 8.5 | |
完全性 [%] | 87.7 | 74 |
冗長性 | 1.7 | 1.4 |
結晶化条件
結晶ID | 方法 | pH | 温度 | 溶液条件 |
1 | VAPOR DIFFUSION, SITTING DROP | 5.5 | 295 | 0.2M lithium sulfate monohydrate, 0.1M bis-tris, 25% w/v PEG 3350, pH 5.5, VAPOR DIFFUSION, SITTING DROP, temperature 295K |