3R5S
Crystal structure of apo-ViuP
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 | 2009-04-28 |
| Detector | MARMOSAIC 225 mm CCD |
| Wavelength(s) | 0.9790 |
| Spacegroup name | C 1 2 1 |
| Unit cell lengths | 76.925, 61.068, 66.852 |
| Unit cell angles | 90.00, 120.56, 90.00 |
Refinement procedure
| Resolution | 33.119 - 1.791 |
| R-factor | 0.1796 |
| Rwork | 0.177 |
| R-free | 0.21320 |
| Structure solution method | SAD |
| RMSD bond length | 0.007 |
| RMSD bond angle | 1.031 |
| Data reduction software | HKL-2000 |
| Data scaling software | HKL-2000 |
| Phasing software | SOLVE |
| Refinement software | PHENIX ((phenix.refine: 1.6.2_432)) |
Data quality characteristics
| Overall | Inner shell | Outer shell | |
| Low resolution limit [Å] | 50.000 | 50.000 | 1.850 |
| High resolution limit [Å] | 1.790 | 3.860 | 1.790 |
| Rmerge | 0.050 | 0.021 | 0.251 |
| Number of reflections | 49200 | ||
| <I/σ(I)> | 27.56 | 55.462 | 3.98 |
| Completeness [%] | 98.7 | 99.8 | 88.2 |
| Redundancy | 3.7 | 3.8 | 3.3 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 4.6 | 293 | 0.2M Ammonium acetate, 0.1M Sodium acetate pH 4.6, 30% w/v Polyethylene glycol 4000, VAPOR DIFFUSION, HANGING DROP, temperature 293K |
