2GOY
Crystal structure of assimilatory adenosine 5'-phosphosulfate reductase with bound APS
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | SSRL BEAMLINE BL9-1 |
| Synchrotron site | SSRL |
| Beamline | BL9-1 |
| Temperature [K] | 123 |
| Detector technology | IMAGE PLATE |
| Collection date | 2005-03-05 |
| Detector | MAR scanner 345 mm plate |
| Wavelength(s) | 0.98397 |
| Spacegroup name | P 1 |
| Unit cell lengths | 60.027, 102.788, 139.374 |
| Unit cell angles | 90.10, 102.57, 89.95 |
Refinement procedure
| Resolution | 38.680 - 2.700 |
| R-factor | 0.232 |
| Rwork | 0.230 |
| R-free | 0.26500 |
| Structure solution method | MAD |
| RMSD bond length | 0.008 |
| RMSD bond angle | 1.500 |
| Data scaling software | SCALA |
| Phasing software | CNS |
| Refinement software | CNS |
Data quality characteristics
| Overall | Inner shell | Outer shell | |
| Low resolution limit [Å] | 38.674 | 38.670 | 2.770 |
| High resolution limit [Å] | 2.700 | 12.070 | 2.700 |
| Rmerge | 0.105 | 0.020 | 0.337 |
| Total number of observations | 1868 | 12387 | |
| Number of reflections | 85404 | 953 | 6341 |
| <I/σ(I)> | 5.9 | 36.4 | 1.9 |
| Completeness [%] | 95.6 | ||
| Redundancy | 2 | 2 | 2 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION | 6.5 | 298 | 1.5M ammonium sulfate, 0.1M sodium cacodylate, 2.5mM APS, pH 6.5, VAPOR DIFFUSION, temperature 298K |
| 1 | VAPOR DIFFUSION | 6.5 | 298 | 1.5M ammonium sulfate, 0.1M sodium cacodylate, 2.5mM APS, pH 6.5, VAPOR DIFFUSION, temperature 298K |
| 1 | VAPOR DIFFUSION | 6.5 | 298 | 1.5M ammonium sulfate, 0.1M sodium cacodylate, 2.5mM APS, pH 6.5, VAPOR DIFFUSION, temperature 298K |
| 1 | VAPOR DIFFUSION | 6.5 | 298 | 1.5M ammonium sulfate, 0.1M sodium cacodylate, 2.5mM APS, pH 6.5, VAPOR DIFFUSION, temperature 298K |
