5WR8
Thaumatin structure determined by SACLA at 1.55 Angstrom
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 | 2015-10-06 |
Detector | MPCCD |
Wavelength(s) | 1.24 |
Spacegroup name | P 41 21 2 |
Unit cell lengths | 58.459, 58.459, 151.639 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 29.229 - 1.550 |
R-factor | 0.1284 |
Rwork | 0.127 |
R-free | 0.15050 |
RMSD bond length | 0.006 |
RMSD bond angle | 0.984 |
Data reduction software | CrystFEL |
Data scaling software | CrystFEL |
Refinement software | PHENIX (1.9_1692) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 30.000 | 1.600 |
High resolution limit [Å] | 1.550 | 1.550 |
Number of reflections | 39121 | |
<I/σ(I)> | 7.7 | 2 |
Completeness [%] | 100.0 | 100 |
Redundancy | 647.6 | 668.5 |
CC(1/2) | 0.988 | 0.760 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | BATCH MODE | 7.3 | 277 | 20 mM N-(2-acetamido) iminodiacetic acid, 2.0 M potassium sodium tartrate |