3V3J
Kinetic and structural studies of thermostabilized mutants of HCA II.
Experimental procedure
| 実験手法 | SINGLE WAVELENGTH |
| Source type | ROTATING ANODE |
| Source details | RIGAKU RUH3R |
| Temperature [K] | 100 |
| Detector technology | IMAGE PLATE |
| Collection date | 2011-08-24 |
| Detector | RIGAKU RAXIS IV++ |
| Wavelength(s) | 1.5418 |
| Spacegroup name | P 21 21 21 |
| 格子定数 [Å] | 42.199, 71.577, 73.649 |
| 格子定数 [度] | 90.00, 90.00, 90.00 |
精密化法
| 残基 | 19.515 - 1.630 |
| R因子 | 0.1843 |
| Rwork | 0.182 |
| R-free | 0.21880 |
| Structure solution method | MOLECULAR REPLACEMENT |
| 結合長の平均二乗偏差(RMSD) [Å] | 0.009 |
| 結合角の平均二乗偏差(RMSD) [度] | 1.290 |
| Data reduction software | DENZO |
| Data scaling software | SCALEPACK |
| Phasing software | PHENIX |
| Refinement software | PHENIX (1.7.2_869) |
Quality characteristics
| Overall | Inner shell | Outer shell | |
| 分解能 [Å] (低) | 20.000 | 20.000 | 1.690 |
| 分解能 [Å] (高) | 1.630 | 3.510 | 1.630 |
| Rmerge_l_obs | 0.070 | 0.044 | 0.489 |
| 独立反射数 | 28381 | ||
| <I/σ(I)> | 13.3 | ||
| 完全性 [%] | 99.3 | 99.9 | 97.6 |
| 冗長性 | 6.3 | 6.7 | 5.6 |
結晶化条件
| 結晶ID | 方法 | pH | 温度 | 溶液条件 |
| 1 | VAPOR DIFFUSION, HANGING DROP | 8.5 | 298 | 30% w/v PEG 4000, 0.2M magnesium chloride hexahydrate, 0.1M TRIS hydrochloride, pH 8.5, VAPOR DIFFUSION, HANGING DROP, temperature 298K |
