5MQW
High-speed fixed-target serial virus crystallography
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | FREE ELECTRON LASER |
Source details | SLAC LCLS BEAMLINE XPP |
Synchrotron site | SLAC LCLS |
Beamline | XPP |
Temperature [K] | 100 |
Detector technology | PIXEL |
Collection date | 2015-07-20 |
Detector | CS-PAD XPP |
Wavelength(s) | 1.301 |
Spacegroup name | I 2 3 |
Unit cell lengths | 102.800, 102.800, 102.800 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 29.676 - 2.400 |
R-factor | 0.1138 |
Rwork | 0.112 |
R-free | 0.14610 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 4ots |
RMSD bond length | 0.003 |
RMSD bond angle | 0.743 |
Data reduction software | cctbx.xfel |
Refinement software | PHENIX ((1.10.1-2155_9999: ???)) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 30.000 | 2.440 |
High resolution limit [Å] | 2.400 | 2.400 |
Rpim | 0.019 | 0.045 |
Number of reflections | 7231 | |
<I/σ(I)> | 18.7 | 6.2 |
Completeness [%] | 100.0 | 100 |
Redundancy | 113.9 | 24.9 |
CC(1/2) | 0.993 | 0.908 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | IN CELL | 7.5 | 301 | Crystals grew within insect cell, incubated at 301K |