2VYZ
Mutant Ala55Phe of Cerebratulus lacteus mini-hemoglobin
Experimental procedure
| 実験手法 | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | ESRF BEAMLINE ID14-1 |
| Synchrotron site | ESRF |
| Beamline | ID14-1 |
| Temperature [K] | 100 |
| Detector technology | CCD |
| Collection date | 2006-11-25 |
| Detector | ADSC CCD |
| Spacegroup name | P 21 21 21 |
| 格子定数 [Å] | 42.880, 43.352, 59.883 |
| 格子定数 [度] | 90.00, 90.00, 90.00 |
精密化法
| 残基 | 24.550 - 1.800 |
| R因子 | 0.19276 |
| Rwork | 0.188 |
| R-free | 0.23003 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 1kr7 |
| 結合長の平均二乗偏差(RMSD) [Å] | 0.013 |
| 結合角の平均二乗偏差(RMSD) [度] | 1.245 |
| Data reduction software | MOSFLM |
| Data scaling software | SCALA |
| Phasing software | MOLREP |
| Refinement software | REFMAC (5.2.0019) |
Quality characteristics
| Overall | Outer shell | |
| 分解能 [Å] (低) | 43.360 | 1.900 |
| 分解能 [Å] (高) | 1.800 | 1.800 |
| Rmerge_l_obs | 0.120 | 0.280 |
| 独立反射数 | 10801 | |
| <I/σ(I)> | 9.5 | 4.1 |
| 完全性 [%] | 99.6 | 99.7 |
| 冗長性 | 3.8 | 3.9 |
結晶化条件
| 結晶ID | 方法 | pH | 温度 | 溶液条件 |
| 1 | 6 | 277 | 60% AMMONIUM SULFATE, 50MM SODIUM ACETATE, PH 6.0, AT 277K |
