5OQ9
XFEL structure of the off state of a reversibly photoswitching fluorescent protein determined using the droplet on demand injection method
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | FREE ELECTRON LASER |
Source details | SACLA BEAMLINE BL3 |
Synchrotron site | SACLA |
Beamline | BL3 |
Temperature [K] | 293 |
Detector technology | CCD |
Collection date | 2016-07-16 |
Detector | MPCCD |
Wavelength(s) | 1.18 |
Spacegroup name | P 21 21 21 |
Unit cell lengths | 39.800, 74.600, 79.200 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 54.300 - 1.510 |
R-factor | 0.178 |
Rwork | 0.175 |
R-free | 0.23400 |
Structure solution method | MOLECULAR REPLACEMENT |
RMSD bond length | 0.020 |
RMSD bond angle | 2.180 |
Data reduction software | MOSFLM |
Data scaling software | SCALA |
Phasing software | MOLREP |
Refinement software | REFMAC (5.6.0117) |
Data quality characteristics
Overall | |
Low resolution limit [Å] | 54.300 |
High resolution limit [Å] | 1.450 |
Number of reflections | 37792 |
<I/σ(I)> | 6.84 |
Completeness [%] | 90.4 |
Redundancy | 11.9 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | BATCH MODE | 293 | 0.2 M lithium sulfate, 0.1 M Tris-Cl pH 8.5, 23-30% PEG 3350, |