1SQM
STRUCTURE OF [R563A] LEUKOTRIENE A4 HYDROLASE
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | MAX II BEAMLINE I711 |
Synchrotron site | MAX II |
Beamline | I711 |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2002-01-22 |
Detector | MARRESEARCH |
Wavelength(s) | 0.96800 |
Spacegroup name | P 21 21 21 |
Unit cell lengths | 78.000, 86.850, 98.950 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 16.480 - 2.300 |
R-factor | 0.191 |
Rwork | 0.190 |
R-free | 0.23000 |
Structure solution method | FOURIER SYNTHESIS |
RMSD bond length | 0.008 |
RMSD bond angle | 1.445 |
Data scaling software | SCALA |
Phasing software | CNS |
Refinement software | CNS |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 16.480 | 2.420 |
High resolution limit [Å] | 2.300 | 2.300 |
Rmerge | 0.092 | |
Number of reflections | 30528 | |
Completeness [%] | 99.7 | 99.7 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | LIQUID DIFFUSION | 8 | 298 | PEG 8000, Sodium Acetate, Imideazole pH 6.8, YbCl2, Bestatin, pH 8.0, LIQUID DIFFUSION, temperature 298K |