4E2G
Crystal structure of Cupin fold protein Sthe2323 from Sphaerobacter thermophilus
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 | 2012-02-02 |
| Detector | ADSC QUANTUM 315r |
| Wavelength(s) | 0.97929 |
| Spacegroup name | C 1 2 1 |
| Unit cell lengths | 193.710, 52.623, 108.818 |
| Unit cell angles | 90.00, 91.24, 90.00 |
Refinement procedure
| Resolution | 50.000 - 1.860 |
| R-factor | 0.1614 |
| Rwork | 0.159 |
| R-free | 0.21110 |
| Structure solution method | SAD |
| RMSD bond length | 0.006 |
| RMSD bond angle | 1.132 |
| Data reduction software | HKL-3000 |
| Data scaling software | HKL-3000 |
| Phasing software | HKL-3000 |
| Refinement software | REFMAC (5.6.0117) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 50.000 | 1.880 |
| High resolution limit [Å] | 1.860 | 1.860 |
| Rmerge | 0.129 | 0.920 |
| Number of reflections | 91471 | |
| <I/σ(I)> | 25.38 | 2.01 |
| Completeness [%] | 98.9 | 93.6 |
| Redundancy | 5.6 | 4.2 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, SITTING DROP | 5.5 | 289 | 0.2M Ammonium acetate, 0.1M Bis-Tris, 25% PEG3350, 20% glycerol, pH 5.5, VAPOR DIFFUSION, SITTING DROP, temperature 289K |
