5X9L
Recombinant thaumatin I at 0.9 Angstrom
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | SPRING-8 BEAMLINE BL26B1 |
Synchrotron site | SPring-8 |
Beamline | BL26B1 |
Temperature [K] | 100 |
Detector technology | IMAGE PLATE |
Collection date | 2016-07-08 |
Detector | RIGAKU RAXIS V |
Wavelength(s) | 0.8 |
Spacegroup name | P 41 21 2 |
Unit cell lengths | 57.702, 57.702, 149.908 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 20.000 - 0.900 |
Rwork | 0.117 |
R-free | 0.12900 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 3al7 |
RMSD bond length | 0.019 |
RMSD bond angle | 0.040 |
Data scaling software | HKL-2000 |
Phasing software | SHELX |
Refinement software | SHELXL-97 |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 50.000 | 0.920 |
High resolution limit [Å] | 0.900 | 0.900 |
Rmerge | 0.068 | 0.498 |
Number of reflections | 187168 | |
<I/σ(I)> | 67.39 | 4.13 |
Completeness [%] | 100.0 | 100 |
Redundancy | 10.6 | 6.6 |
CC(1/2) | 0.998 | 0.901 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 7 | 293 | 0.1 M ADA, 0.75 M sodium potassium tartrate |