2YAH
X-ray induced reduction of laccase from Thermus thermophilus HB27 (25. 0-37.5 percent dose)
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | NSLS BEAMLINE X6A |
Synchrotron site | NSLS |
Beamline | X6A |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2010-06-15 |
Detector | ADSC QUANTUM 210 |
Spacegroup name | C 2 2 21 |
Unit cell lengths | 93.633, 110.293, 96.273 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 28.669 - 1.800 |
R-factor | 0.1497 |
Rwork | 0.148 |
R-free | 0.17870 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 2xu9 |
RMSD bond length | 0.010 |
RMSD bond angle | 1.389 |
Data reduction software | XDS |
Data scaling software | SCALA |
Phasing software | PHASER |
Refinement software | PHENIX ((PHENIX.REFINE)) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 29.000 | 1.900 |
High resolution limit [Å] | 1.800 | 1.800 |
Rmerge | 0.120 | 0.300 |
Number of reflections | 44546 | |
<I/σ(I)> | 7.8 | 4.2 |
Completeness [%] | 96.9 | 95.5 |
Redundancy | 3.4 | 3.4 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | 7.5 | 0.1 M HEPES PH 7.5, 70% MPD |