3GYO
Se-Met Rtt106p
Experimental procedure
| 実験手法 | MAD |
| Source type | SYNCHROTRON |
| Source details | NSLS BEAMLINE X12C |
| Synchrotron site | NSLS |
| Beamline | X12C |
| Temperature [K] | 100 |
| Wavelength(s) | 0.9792, 0.9790, 0.9600 |
| Spacegroup name | F 4 3 2 |
| 格子定数 [Å] | 262.498, 262.498, 262.498 |
| 格子定数 [度] | 90.00, 90.00, 90.00 |
精密化法
| 残基 | 20.000 - 3.100 |
| R因子 | 0.217 |
| Rwork | 0.215 |
| R-free | 0.26000 |
| Structure solution method | MAD |
| 結合長の平均二乗偏差(RMSD) [Å] | 0.014 |
| 結合角の平均二乗偏差(RMSD) [度] | 1.742 |
| Data reduction software | DENZO |
| Data scaling software | SCALEPACK |
| Phasing software | SOLVE |
| Refinement software | REFMAC (5.2.0019) |
Quality characteristics
| Overall | Inner shell | Outer shell | |
| 分解能 [Å] (低) | 50.000 | 50.000 | 3.210 |
| 分解能 [Å] (高) | 3.100 | 6.670 | 3.100 |
| Rmerge_l_obs | 0.103 | 0.050 | 0.389 |
| 独立反射数 | 14605 | ||
| <I/σ(I)> | 28.684 | ||
| 完全性 [%] | 100.0 | 99.8 | 100 |
| 冗長性 | 18 | 15.9 | 18.3 |
結晶化条件
| 結晶ID | 方法 | pH | 温度 | 溶液条件 |
| 1 | VAPOR DIFFUSION, HANGING DROP | 7 | 285 | 1.5M DL-malic, pH 7.0, VAPOR DIFFUSION, HANGING DROP, temperature 285K |
