3S6K
Crystal structure of xcNAGS
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | APS BEAMLINE 22-ID |
| Synchrotron site | APS |
| Beamline | 22-ID |
| Temperature [K] | 298 |
| Detector technology | CCD |
| Collection date | 2006-10-05 |
| Detector | MARMOSAIC 300 mm CCD |
| Wavelength(s) | 0.9734 |
| Spacegroup name | P 62 2 2 |
| Unit cell lengths | 133.228, 133.228, 191.364 |
| Unit cell angles | 90.00, 90.00, 120.00 |
Refinement procedure
| Resolution | 46.072 - 2.802 |
| R-factor | 0.3244 |
| Rwork | 0.321 |
| R-free | 0.38780 |
| RMSD bond length | 0.010 |
| RMSD bond angle | 1.647 |
| Data reduction software | HKL-2000 |
| Data scaling software | HKL-2000 |
| Phasing software | ISIR |
| Refinement software | PHENIX (1.5_2) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 46.072 | 2.900 |
| High resolution limit [Å] | 2.800 | 2.800 |
| Rmerge | 0.065 | 0.334 |
| Number of reflections | 33401 | |
| <I/σ(I)> | 55.2 | 2.5 |
| Completeness [%] | 83.3 | 54 |
| Redundancy | 17.2 | 8 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 7.5 | 291 | 1.4 M Sodium malonate, pH 7.5, VAPOR DIFFUSION, HANGING DROP, temperature 291K |
