4OPV
Unliganded crystal structure of P domain from norovirus strain Farmington Hills 2004 co-crystallized with HBGA type Lea
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | ESRF BEAMLINE ID23-1 |
Synchrotron site | ESRF |
Beamline | ID23-1 |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2013-06-22 |
Detector | ADSC QUANTUM 315r |
Wavelength(s) | 0.93223 |
Spacegroup name | P 21 21 21 |
Unit cell lengths | 63.130, 90.150, 109.480 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 46.758 - 1.850 |
R-factor | 0.1495 |
Rwork | 0.148 |
R-free | 0.17490 |
Structure solution method | MOLECULAR REPLACEMENT |
RMSD bond length | 0.006 |
RMSD bond angle | 1.078 |
Data reduction software | XDS |
Data scaling software | XSCALE |
Phasing software | PHASER (2.5.3) |
Refinement software | PHENIX (1.8.2_1309) |
Data quality characteristics
Overall | Inner shell | Outer shell | |
Low resolution limit [Å] | 50.000 | 1.900 | |
High resolution limit [Å] | 1.850 | 8.270 | 1.850 |
Rmerge | 0.062 | 0.013 | 0.420 |
Number of reflections | 53177 | ||
<I/σ(I)> | 20.94 | 62.72 | 3.52 |
Completeness [%] | 98.4 | 97.8 | 86.2 |
Redundancy | 4.3 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 291 | PEG 3350, Magnesium formate, VAPOR DIFFUSION, HANGING DROP, temperature 291K |