6F8Y
Crystal structure of P. abyssi Sua5 complexed with L-threonine
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | SOLEIL BEAMLINE PROXIMA 1 |
Synchrotron site | SOLEIL |
Beamline | PROXIMA 1 |
Temperature [K] | 100 |
Detector technology | PIXEL |
Collection date | 2011-12-04 |
Detector | DECTRIS PILATUS 6M |
Wavelength(s) | 0.98011 |
Spacegroup name | C 1 2 1 |
Unit cell lengths | 152.230, 142.380, 103.860 |
Unit cell angles | 90.00, 101.80, 90.00 |
Refinement procedure
Resolution | 48.780 - 2.860 |
R-factor | 0.1912 |
Rwork | 0.188 |
R-free | 0.25170 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 2eqa |
RMSD bond length | 0.013 |
RMSD bond angle | 1.671 |
Data reduction software | XDS |
Data scaling software | XDS |
Phasing software | MOLREP |
Refinement software | REFMAC (5.8.0135) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 48.781 | 3.030 |
High resolution limit [Å] | 2.860 | 2.860 |
Rmeas | 0.090 | |
Number of reflections | 49934 | |
<I/σ(I)> | 10.66 | |
Completeness [%] | 99.3 | |
Redundancy | 3.76 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, SITTING DROP | 277 | ammonium sulfate |