6I1A
Crystal structure of rutinosidase from Aspergillus niger
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | BESSY BEAMLINE 14.1 |
Synchrotron site | BESSY |
Beamline | 14.1 |
Temperature [K] | 100 |
Detector technology | PIXEL |
Collection date | 2016-04-20 |
Detector | DECTRIS PILATUS 6M |
Wavelength(s) | 0.918 |
Spacegroup name | P 21 21 21 |
Unit cell lengths | 53.068, 97.359, 139.259 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 46.600 - 1.270 |
R-factor | 0.15949 |
Rwork | 0.159 |
R-free | 0.17822 |
Structure solution method | SIRAS |
RMSD bond length | 0.015 |
RMSD bond angle | 1.925 |
Data reduction software | XDS |
Data scaling software | XSCALE |
Phasing software | HKL2Map |
Refinement software | REFMAC (5.8.0238) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 50.000 | 1.350 |
High resolution limit [Å] | 1.270 | 1.270 |
Rmeas | 0.068 | 1.446 |
Number of reflections | 180049 | 22781 |
<I/σ(I)> | 9.58 | 0.78 |
Completeness [%] | 94.6 | 74.8 |
Redundancy | 2.98 | 2.19 |
CC(1/2) | 0.999 | 0.359 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | MICROBATCH | 5.5 | 291 | 20 mM Amonium Sulfate, 0.1 M Bis-Tris, 25% PEG 3350 |