3PQV
Cyclase homolog
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | NSLS BEAMLINE X25 |
| Synchrotron site | NSLS |
| Beamline | X25 |
| Temperature [K] | 130 |
| Detector technology | CCD |
| Collection date | 2010-07-15 |
| Detector | ADSC QUANTUM 315 |
| Wavelength(s) | 1.1 |
| Spacegroup name | P 21 21 21 |
| Unit cell lengths | 59.317, 138.821, 228.945 |
| Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
| Resolution | 49.242 - 2.609 |
| R-factor | 0.207 |
| Rwork | 0.204 |
| R-free | 0.25920 |
| Structure solution method | SAD |
| RMSD bond length | 0.003 |
| RMSD bond angle | 0.704 |
| Data reduction software | HKL-2000 |
| Data scaling software | SCALEPACK |
| Phasing software | PHENIX |
| Refinement software | PHENIX ((phenix.refine: 1.6.4_486)) |
Data quality characteristics
| Overall | Inner shell | Outer shell | |
| Low resolution limit [Å] | 50.000 | 50.000 | 2.640 |
| High resolution limit [Å] | 2.600 | 7.050 | 2.600 |
| Rmerge | 0.086 | 0.031 | 0.727 |
| Number of reflections | 57424 | ||
| <I/σ(I)> | 23.83 | 82.06 | 2.24 |
| Completeness [%] | 97.9 | 99.7 | 95.1 |
| Redundancy | 9.5 | 12.6 | 7.5 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 8 | 293 | 0.1M Na Tartrate, 12.5% (w/v) PEG 3350. Cryoprotection via addition of 20% glycerol, pH 8.0, VAPOR DIFFUSION, HANGING DROP, temperature 293K |
