3KX0
Crystal Structure of the PAS domain of Rv1364c
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | ESRF BEAMLINE BM14 |
| Synchrotron site | ESRF |
| Beamline | BM14 |
| Temperature [K] | 100 |
| Detector technology | CCD |
| Collection date | 2008-11-24 |
| Detector | MARMOSAIC 225 mm CCD |
| Wavelength(s) | .95373 |
| Spacegroup name | P 62 2 2 |
| Unit cell lengths | 59.609, 59.609, 173.327 |
| Unit cell angles | 90.00, 90.00, 120.00 |
Refinement procedure
| Resolution | 49.475 - 2.300 |
| R-factor | 0.2349 |
| Rwork | 0.233 |
| R-free | 0.27440 |
| Structure solution method | SAD |
| RMSD bond length | 0.007 |
| RMSD bond angle | 1.078 |
| Data reduction software | MOSFLM |
| Data scaling software | SCALA |
| Phasing software | SOLVE |
| Refinement software | PHENIX ((phenix.refine: 1.5_2)) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 57.740 | 2.400 |
| High resolution limit [Å] | 2.300 | 2.300 |
| Rmerge | 0.097 | 0.573 |
| Number of reflections | 8811 | |
| <I/σ(I)> | 21.2 | 5.2 |
| Completeness [%] | 100.0 | 100 |
| Redundancy | 17 | 17.7 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | Under oil | 8 | 300 | 2.5M ammonium sulphate, 5% Isopropanol, .1M tris-chloride, pH 8, Under oil, temperature 300K |
