3OUG
Crystal structure of cleaved L-aspartate-alpha-decarboxylase from Francisella tularensis
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | APS BEAMLINE 19-ID |
Synchrotron site | APS |
Beamline | 19-ID |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2009-10-09 |
Detector | ADSC QUANTUM 315r |
Wavelength(s) | 0.9794 |
Spacegroup name | P 1 21 1 |
Unit cell lengths | 79.934, 80.525, 85.025 |
Unit cell angles | 90.00, 104.33, 90.00 |
Refinement procedure
Resolution | 28.660 - 1.550 |
R-factor | 0.17196 |
Rwork | 0.172 |
R-free | 0.19704 |
Structure solution method | SAD with MR |
Starting model (for MR) | 2c45 |
RMSD bond length | 0.014 |
RMSD bond angle | 1.510 |
Data reduction software | HKL-3000 |
Data scaling software | HKL-3000 |
Phasing software | Auto-Rickshaw |
Refinement software | REFMAC (5.5.0109) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 40.000 | 1.580 |
High resolution limit [Å] | 1.550 | 1.550 |
Rmerge | 0.071 | 0.663 |
Number of reflections | 150740 | |
<I/σ(I)> | 27.6 | |
Completeness [%] | 99.7 | 99.7 |
Redundancy | 3.7 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 5.5 | 291 | 0.2 M Lithium sulfate, 0.1 M Bis-Tris, 25% PeG 3350, pH 5.5, VAPOR DIFFUSION, HANGING DROP, temperature 291K |