Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | SPRING-8 BEAMLINE BL41XU |
Synchrotron site | SPring-8 |
Beamline | BL41XU |
Temperature [K] | 173 |
Detector technology | PIXEL |
Collection date | 2018-06-22 |
Detector | DECTRIS PILATUS 6M |
Wavelength(s) | 0.8 |
Spacegroup name | P 63 2 2 |
Unit cell lengths | 158.520, 158.520, 104.871 |
Unit cell angles | 90.00, 90.00, 120.00 |
Refinement procedure
Resolution | 29.960 - 2.300 |
R-factor | 0.1596 |
Rwork | 0.158 |
R-free | 0.18810 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 3qnv |
RMSD bond length | 0.014 |
RMSD bond angle | 1.795 |
Data reduction software | iMOSFLM |
Data scaling software | SCALA |
Phasing software | PHASER |
Refinement software | REFMAC (5.8.0258) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 30.000 | 2.420 |
High resolution limit [Å] | 2.300 | 2.300 |
Rmerge | 0.228 | 0.330 |
Rpim | 0.238 | 0.384 |
Number of reflections | 34712 | 3021 |
<I/σ(I)> | 2.4107 | 2.3 |
Completeness [%] | 99.3 | 96.22 |
Redundancy | 10.61 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | COUNTER-DIFFUSION | 293 | 1.4 SA |