6FEZ
Ryegrass mottle virus protease domain
Experimental procedure
実験手法 | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | BESSY BEAMLINE 14.1 |
Synchrotron site | BESSY |
Beamline | 14.1 |
Temperature [K] | 90 |
Detector technology | PIXEL |
Collection date | 2017-11-04 |
Detector | DECTRIS PILATUS 6M |
Wavelength(s) | 0.9184 |
Spacegroup name | P 1 21 1 |
格子定数 [Å] | 37.110, 115.990, 57.920 |
格子定数 [度] | 90.00, 105.27, 90.00 |
精密化法
残基 | 57.990 - 2.300 |
R因子 | 0.23229 |
Rwork | 0.229 |
R-free | 0.29018 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 1zyo |
結合長の平均二乗偏差(RMSD) [Å] | 0.015 |
結合角の平均二乗偏差(RMSD) [度] | 1.767 |
Data scaling software | SCALA |
Phasing software | MOLREP |
Refinement software | REFMAC (5.8.0189) |
Quality characteristics
Overall | Outer shell | |
分解能 [Å] (低) | 57.990 | 2.420 |
分解能 [Å] (高) | 2.300 | 2.300 |
Rmerge_l_obs | 0.123 | 0.548 |
Rmeas | 0.149 | 0.662 |
Rpim | 0.083 | 0.365 |
独立反射数 | 19160 | 2981 |
<I/σ(I)> | 5.3 | 2.1 |
完全性 [%] | 96.0 | 98.69 |
冗長性 | 3 | 3.1 |
CC(1/2) | 0.989 | 0.644 |
結晶化条件
結晶ID | 方法 | pH | 温度 | 溶液条件 |
1 | VAPOR DIFFUSION, SITTING DROP | 7.5 | 293 | 0.1 M HEPES 7.5, 22.5% PEG 3350, 0.22M LiSO4, 3% DMSO |