5NB8
Structure of vWC domain from CCN3
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | DIAMOND BEAMLINE I04-1 |
| Synchrotron site | Diamond |
| Beamline | I04-1 |
| Temperature [K] | 100 |
| Detector technology | PIXEL |
| Collection date | 2011-07-30 |
| Detector | DECTRIS PILATUS 2M |
| Wavelength(s) | 0.9173 |
| Spacegroup name | P 1 |
| Unit cell lengths | 38.400, 43.100, 72.300 |
| Unit cell angles | 75.30, 82.00, 89.90 |
Refinement procedure
| Resolution | 28.580 - 2.100 |
| R-factor | 0.1903 |
| Rwork | 0.189 |
| R-free | 0.21570 |
| Structure solution method | MOLECULAR REPLACEMENT |
| RMSD bond length | 0.007 |
| RMSD bond angle | 0.872 |
| Data reduction software | XDS |
| Data scaling software | XSCALE |
| Phasing software | AMoRE |
| Refinement software | PHENIX ((1.11.1_2575: ???)) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 28.580 | 2.200 |
| High resolution limit [Å] | 2.100 | 2.100 |
| Rmerge | 0.083 | |
| Number of reflections | 25475 | 3237 |
| <I/σ(I)> | 7.92 | 2.6 |
| Completeness [%] | 98.1 | 95.3 |
| Redundancy | 5.1 | 4.7 |
| CC(1/2) | 0.998 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 293 | 0.8 M Na/K Tartrate, 0.4M NaCl, 0.1 M Imidazole, pH 8.0 |
