3RY7
Crystal Structure of Sa239
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | SSRF BEAMLINE BL17U |
| Synchrotron site | SSRF |
| Beamline | BL17U |
| Temperature [K] | 100 |
| Detector technology | CCD |
| Collection date | 2010-09-12 |
| Detector | RAYONIX MX-325 |
| Wavelength(s) | 0.9794 |
| Spacegroup name | P 65 2 2 |
| Unit cell lengths | 93.752, 93.752, 165.270 |
| Unit cell angles | 90.00, 90.00, 120.00 |
Refinement procedure
| Resolution | 50.000 - 2.150 |
| R-factor | 0.21756 |
| Rwork | 0.216 |
| R-free | 0.25295 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 1gqt |
| RMSD bond length | 0.011 |
| RMSD bond angle | 1.181 |
| Data reduction software | HKL-2000 |
| Data scaling software | HKL-2000 |
| Phasing software | PHASER |
| Refinement software | REFMAC (5.5.0102) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 50.000 | 2.190 |
| High resolution limit [Å] | 2.150 | 2.150 |
| Rmerge | 0.108 | |
| Number of reflections | 24271 | |
| <I/σ(I)> | 20.3 | |
| Completeness [%] | 99.9 | 100 |
| Redundancy | 9.1 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, SITTING DROP | 5.6 | 295 | 23% PEG 3000 (w/v), 0.1M sodium citrate, pH 5.6, VAPOR DIFFUSION, SITTING DROP, temperature 295K |
