4IMC
Crystal Structure of Pasteurella multocida N-Acetyl-D-Neuraminic acid lyase
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | SSRL BEAMLINE BL7-1 |
Synchrotron site | SSRL |
Beamline | BL7-1 |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2008-01-10 |
Detector | ADSC QUANTUM 315r |
Wavelength(s) | 0.97946 |
Spacegroup name | P 1 21 1 |
Unit cell lengths | 80.946, 113.471, 82.238 |
Unit cell angles | 90.00, 111.35, 90.00 |
Refinement procedure
Resolution | 113.470 - 1.850 |
R-factor | 0.1742 |
Rwork | 0.172 |
R-free | 0.20890 |
Structure solution method | MOLECULAR REPLACEMENT |
RMSD bond length | 0.015 |
RMSD bond angle | 1.353 |
Data reduction software | MOSFLM |
Data scaling software | SCALA |
Phasing software | PHASER |
Refinement software | REFMAC |
Data quality characteristics
Overall | |
Low resolution limit [Å] | 113.471 |
High resolution limit [Å] | 1.850 |
Rmerge | 0.055 |
Number of reflections | 112841 |
<I/σ(I)> | 9.3 |
Completeness [%] | 95.8 |
Redundancy | 3.3 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 6.2 | 298 | 21% PEG1000, 0.15 M sodium chloride, 0.1 M sodium potassium phosphate, pH 6.2, VAPOR DIFFUSION, HANGING DROP, temperature 298K |