5K5K
Crystal structure of laccasse from Thermus thermophilus HB27 (ascorbic acid 10 min)
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 | 2012-09-03 |
Detector | ADSC QUANTUM 270 |
Wavelength(s) | 0.9184 |
Spacegroup name | C 2 2 21 |
Unit cell lengths | 93.440, 109.860, 96.050 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 19.632 - 1.796 |
R-factor | 0.1773 |
Rwork | 0.175 |
R-free | 0.21590 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 2xu9 |
RMSD bond length | 0.006 |
RMSD bond angle | 0.937 |
Data reduction software | XDS |
Data scaling software | XDS |
Phasing software | PHASER |
Refinement software | PHENIX (1.10.1_2155) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 19.632 | 1.900 |
High resolution limit [Å] | 1.796 | 1.796 |
Rmerge | 0.082 | 0.520 |
Number of reflections | 42011 | |
<I/σ(I)> | 10.83 | 2.02 |
Completeness [%] | 91.2 | 94 |
Redundancy | 2.45 | 2.39 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 8 | 277 | 0.1 M HEPES, pH 7.5, 70% MPD |