2AMB
Crystal structure of human androgen receptor ligand binding domain in complex with tetrahydrogestrinone
Experimental procedure
| 実験手法 | SINGLE WAVELENGTH |
| Source type | ROTATING ANODE |
| Source details | RIGAKU RU200 |
| Temperature [K] | 100 |
| Detector technology | IMAGE PLATE |
| Collection date | 2004-11-10 |
| Detector | RIGAKU RAXIS II |
| Wavelength(s) | 1.5418 |
| Spacegroup name | P 21 21 21 |
| 格子定数 [Å] | 54.310, 66.040, 71.370 |
| 格子定数 [度] | 90.00, 90.00, 90.00 |
精密化法
| 残基 | 19.300 - 1.750 |
| R因子 | 0.194 |
| Rwork | 0.186 |
| R-free | 0.20900 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 2ama |
| 結合長の平均二乗偏差(RMSD) [Å] | 0.029 |
| 結合角の平均二乗偏差(RMSD) [度] | 2.400 |
| Data reduction software | CrystalClear ((MSC/RIGAKU)) |
| Data scaling software | XSCALE |
| Phasing software | AMoRE |
| Refinement software | CNS (1.1) |
Quality characteristics
| Overall | Outer shell | |
| 分解能 [Å] (低) | 19.300 | 1.800 |
| 分解能 [Å] (高) | 1.750 | 1.750 |
| Rmerge_l_obs | 0.064 | 0.365 |
| 独立反射数 | 25459 | 1358 |
| <I/σ(I)> | 18.01 | 3.01 |
| 完全性 [%] | 94.6 | 63.8 |
| 冗長性 | 6.4 | 2 |
結晶化条件
| 結晶ID | 方法 | pH | 温度 | 溶液条件 |
| 1 | VAPOR DIFFUSION, HANGING DROP | 6.5 | 293 | Na/K tartrate. MgSO4, Hepes, pH 6.5, VAPOR DIFFUSION, HANGING DROP, temperature 293K |
