5MJG
Single-shot pink beam serial crystallography: Thaumatin
Experimental procedure
Experimental method | LAUE |
Source type | SYNCHROTRON |
Source details | APS BEAMLINE 14-ID-B |
Synchrotron site | APS |
Beamline | 14-ID-B |
Temperature [K] | 293 |
Detector technology | CCD |
Collection date | 2016-07-10 |
Detector | RAYONIX MX340-HS |
Wavelength(s) | 1.1-1.3 |
Spacegroup name | P 41 21 2 |
Unit cell lengths | 58.400, 58.400, 152.100 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 14.980 - 2.100 |
R-factor | 0.15638687993 |
Rwork | 0.154 |
R-free | 0.19958 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 1KWN |
RMSD bond length | 0.002 |
RMSD bond angle | 0.494 |
Data reduction software | Epinorm |
Phasing software | PHASER |
Refinement software | PHENIX (1.11_2567) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 30.000 | 2.200 |
High resolution limit [Å] | 1.980 | 2.100 |
Rmerge | 0.041 | |
Number of reflections | 6850 | |
<I/σ(I)> | 38.2 | |
Completeness [%] | 36.6 | 12.7 |
Redundancy | 1 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 293 | Sodium Tartrate |