5HIH
Crystal structure of the macro domain in Middle-East Respiratory Syndrome Coronavirus
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | PETRA III, DESY BEAMLINE P11 |
| Synchrotron site | PETRA III, DESY |
| Beamline | P11 |
| Temperature [K] | 100 |
| Detector technology | IMAGE PLATE |
| Collection date | 2013-04-03 |
| Detector | MAR scanner 345 mm plate |
| Wavelength(s) | 1.033 |
| Spacegroup name | P 2 21 21 |
| Unit cell lengths | 31.580, 65.170, 90.760 |
| Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
| Resolution | 52.940 - 1.660 |
| R-factor | 0.14272 |
| Rwork | 0.141 |
| R-free | 0.17669 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 2fav |
| RMSD bond length | 0.023 |
| RMSD bond angle | 2.292 |
| Data reduction software | XDS |
| Data scaling software | SCALA |
| Phasing software | MOLREP |
| Refinement software | REFMAC (5.8.0131) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 52.940 | 1.750 |
| High resolution limit [Å] | 1.660 | 1.660 |
| Rmerge | 0.061 | 0.177 |
| Number of reflections | 21709 | |
| <I/σ(I)> | 23.9 | 8.9 |
| Completeness [%] | 99.7 | 99 |
| Redundancy | 12.3 | 12.1 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, SITTING DROP | 7 | 291 | 1.3 M sodium citrate tribasic dihydrate, 0.1 M Bis-Tris propane pH7.0. |
