2XKH
Xe derivative of C.lacteus mini-Hb Leu86Ala mutant
Experimental procedure
| 実験手法 | SINGLE WAVELENGTH |
| Source type | ROTATING ANODE |
| Source details | RIGAKU RUH3R |
| Temperature [K] | 100 |
| Detector technology | IMAGE PLATE |
| Detector | MARRESEARCH |
| Spacegroup name | P 21 21 21 |
| 格子定数 [Å] | 42.919, 43.011, 59.472 |
| 格子定数 [度] | 90.00, 90.00, 90.00 |
精密化法
| 残基 | 18.290 - 2.310 |
| R因子 | 0.20102 |
| Rwork | 0.194 |
| R-free | 0.26610 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 1kr7 |
| 結合長の平均二乗偏差(RMSD) [Å] | 0.010 |
| 結合角の平均二乗偏差(RMSD) [度] | 1.073 |
| Data reduction software | MOSFLM |
| Data scaling software | SCALA |
| Phasing software | MOLREP |
| Refinement software | REFMAC (5.5.0072) |
Quality characteristics
| Overall | Outer shell | |
| 分解能 [Å] (低) | 35.000 | 2.340 |
| 分解能 [Å] (高) | 2.300 | 2.300 |
| Rmerge_l_obs | 0.090 | 0.400 |
| 独立反射数 | 5031 | |
| <I/σ(I)> | 8.6 | |
| 完全性 [%] | 97.5 | 93 |
| 冗長性 | 3.5 |
結晶化条件
| 結晶ID | 方法 | pH | 温度 | 溶液条件 |
| 1 | 6 | 277 | 60% AMMONIUM SULPHATE, 50MM SODIUM ACETATE PH 6.0, AT 4C |
