4M0G
The crystal structure of an adenylosuccinate synthetase from Bacillus anthracis str. Ames Ancestor.
Experimental procedure
Experimental method | MAD |
Source type | SYNCHROTRON |
Source details | APS BEAMLINE 19-ID |
Synchrotron site | APS |
Beamline | 19-ID |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2009-04-06 |
Detector | ADSC QUANTUM 315r |
Wavelength(s) | 0.97940, 0.97957 |
Spacegroup name | P 41 21 2 |
Unit cell lengths | 76.498, 76.498, 342.797 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 45.742 - 2.152 |
R-factor | 0.1942 |
Rwork | 0.192 |
R-free | 0.24300 |
Structure solution method | MAD |
RMSD bond length | 0.008 |
RMSD bond angle | 1.037 |
Data reduction software | HKL-3000 |
Data scaling software | HKL-3000 |
Phasing software | SHELXD |
Refinement software | PHENIX ((phenix.refine: 1.8.2_1309)) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 46.000 | 2.190 |
High resolution limit [Å] | 2.150 | 2.150 |
Rmerge | 0.099 | 0.643 |
Number of reflections | 55297 | |
<I/σ(I)> | 40.2 | 4.3 |
Completeness [%] | 97.3 | 99.2 |
Redundancy | 9.1 | 8.8 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, SITTING DROP | 7 | 289 | 25% (w/v) PEG1500, pH 7.0, VAPOR DIFFUSION, SITTING DROP, temperature 289K |