3L14
Human Carbonic Anhydrase II complexed with Althiazide
Experimental procedure
| 実験手法 | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | CHESS BEAMLINE A1 |
| Synchrotron site | CHESS |
| Beamline | A1 |
| Detector technology | CCD |
| Collection date | 2009-10-15 |
| Detector | ADSC QUANTUM 210 |
| Wavelength(s) | 0.9780 |
| Spacegroup name | P 1 21 1 |
| 格子定数 [Å] | 42.158, 41.396, 72.391 |
| 格子定数 [度] | 90.00, 104.37, 90.00 |
精密化法
| 残基 | 20.000 - 1.220 |
| Rwork | 0.130 |
| R-free | 0.17330 |
| Structure solution method | AB INITIO |
| Starting model (for MR) | NONE |
| 結合長の平均二乗偏差(RMSD) [Å] | 0.012 |
| 結合角の平均二乗偏差(RMSD) [度] | 0.029 |
| Data reduction software | HKL-2000 |
| Data scaling software | HKL-2000 |
| Phasing software | SHELX |
| Refinement software | SHELXL-97 |
Quality characteristics
| Overall | Outer shell | |
| 分解能 [Å] (低) | 50.000 | 1.240 |
| 分解能 [Å] (高) | 1.220 | 1.220 |
| 独立反射数 | 65974 | |
| 完全性 [%] | 92.3 | |
| 冗長性 | 5.3 |
結晶化条件
| 結晶ID | 方法 | pH | 温度 | 溶液条件 |
| 1 | VAPOR DIFFUSION, HANGING DROP | 9 | 298 | 50 mM Tris-HCl, 1.3 M Sodium Citrate, pH 9.0, VAPOR DIFFUSION, HANGING DROP, temperature 298K |
