6Q5I
Crystal structure of a CC-Hex mutant that forms an antiparallel four-helix coiled coil CC-Hex*-L24E
Experimental procedure
実験手法 | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | DIAMOND BEAMLINE I03 |
Synchrotron site | Diamond |
Beamline | I03 |
Temperature [K] | 80 |
Detector technology | PIXEL |
Collection date | 2018-03-04 |
Detector | DECTRIS PILATUS 6M |
Wavelength(s) | 0.97628 |
Spacegroup name | P 61 2 2 |
格子定数 [Å] | 69.070, 69.070, 35.490 |
格子定数 [度] | 90.00, 90.00, 120.00 |
精密化法
残基 | 17.380 - 1.760 |
R因子 | 0.1843 |
Rwork | 0.183 |
R-free | 0.20731 |
Structure solution method | MOLECULAR REPLACEMENT |
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] | 1.781 |
Data reduction software | DIALS (1.8.5-g9e40d7de-release) |
Data scaling software | Aimless (0.5.32) |
Phasing software | PHASER (2.8.2) |
Refinement software | REFMAC (5.8.0238) |
Quality characteristics
Overall | Inner shell | Outer shell | |
分解能 [Å] (低) | 17.380 | 17.380 | 1.810 |
分解能 [Å] (高) | 1.760 | 7.870 | 1.760 |
Rmerge_l_obs | 0.205 | 0.051 | 4.738 |
Rmeas | 0.208 | 0.052 | 4.800 |
Rpim | 0.034 | 0.010 | 0.763 |
独立反射数 | 5281 | 75 | 382 |
<I/σ(I)> | 12.9 | 52.4 | 1 |
完全性 [%] | 100.0 | 91.2 | 100 |
冗長性 | 36.5 | 27.3 | 39.2 |
CC(1/2) | 0.999 | 0.999 | 0.661 |
結晶化条件
結晶ID | 方法 | pH | 温度 | 溶液条件 |
1 | VAPOR DIFFUSION, SITTING DROP | 8.5 | 293 | 1.0 M Ammonium Sulphate and 50 mM Tris |