1S5A
Crystal Structure of Putative Isomerase from Bacillus subtilis
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | APS BEAMLINE 19-BM |
| Synchrotron site | APS |
| Beamline | 19-BM |
| Temperature [K] | 100 |
| Detector technology | CCD |
| Collection date | 2003-12-14 |
| Detector | SBC-3 |
| Wavelength(s) | 0.9793 |
| Spacegroup name | P 1 |
| Unit cell lengths | 43.613, 55.725, 72.405 |
| Unit cell angles | 102.47, 99.98, 106.51 |
Refinement procedure
| Resolution | 34.080 - 1.700 |
| R-factor | 0.199 |
| Rwork | 0.199 |
| R-free | 0.23600 |
| Structure solution method | SAD |
| RMSD bond length | 0.009 |
| RMSD bond angle | 1.500 |
| Data reduction software | HKL-2000 |
| Data scaling software | HKL-2000 |
| Phasing software | CNS |
| Refinement software | CNS (1.1) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 34.080 | 1.760 |
| High resolution limit [Å] | 1.700 | 1.700 |
| Rmerge | 0.095 | 0.504 |
| Number of reflections | 64170 | |
| <I/σ(I)> | 8.5 | 2.2 |
| Completeness [%] | 94.6 | 71.2 |
| Redundancy | 4.7 | 3.5 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 5.3 | 298 | ammonium sulfate, PEG 4000, glycerol, sodium acetate, pH 5.3, VAPOR DIFFUSION, HANGING DROP, temperature 298K |
