3EJG
Crystal structure of HCoV-229E X-domain
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | MAX II BEAMLINE I911-2 |
Synchrotron site | MAX II |
Beamline | I911-2 |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2008-04-04 |
Detector | MARRESEARCH |
Spacegroup name | P 1 21 1 |
Unit cell lengths | 33.560, 65.890, 38.020 |
Unit cell angles | 90.00, 110.07, 90.00 |
Refinement procedure
Resolution | 65.940 - 1.780 |
R-factor | 0.167 |
Rwork | 0.165 |
R-free | 0.20500 |
Structure solution method | MOLECULAR REPLACEMENT |
RMSD bond length | 0.013 |
RMSD bond angle | 1.284 |
Data reduction software | MOSFLM |
Data scaling software | SCALA (3.2.25) |
Phasing software | PHASER |
Refinement software | REFMAC (5.3.0037) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 65.940 | 1.880 |
High resolution limit [Å] | 1.780 | 1.780 |
Rmerge | 0.052 | 0.155 |
Number of reflections | 14479 | |
<I/σ(I)> | 9.067 | 4.4 |
Completeness [%] | 96.9 | 89.9 |
Redundancy | 4.2 | 3.8 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | 8.5 | 285.15 | 20% PEG 8000, 0.1 M TRIS PH 8.5, 5% MPD, temperature 285.15K |