4P9F
E. coli McbR/YncC
Experimental procedure
| Experimental method | MAD |
| Source type | SYNCHROTRON |
| Source details | NSLS BEAMLINE X25 |
| Synchrotron site | NSLS |
| Beamline | X25 |
| Temperature [K] | 100 |
| Detector technology | PIXEL |
| Collection date | 2011-08-15 |
| Detector | DECTRIS PILATUS 6M |
| Wavelength(s) | 0.9793, 0.9300 |
| Spacegroup name | P 63 |
| Unit cell lengths | 107.581, 107.581, 72.715 |
| Unit cell angles | 90.00, 90.00, 120.00 |
Refinement procedure
| Resolution | 46.584 - 2.099 |
| R-factor | 0.1674 |
| Rwork | 0.165 |
| R-free | 0.20860 |
| Structure solution method | SAD |
| RMSD bond length | 0.008 |
| RMSD bond angle | 1.003 |
| Data reduction software | DENZO |
| Data scaling software | SCALEPACK |
| Refinement software | PHENIX ((phenix.refine: 1.8.4_1496)) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 46.584 | 2.140 |
| High resolution limit [Å] | 2.099 | 2.100 |
| Rmerge | 0.083 | 0.558 |
| Number of reflections | 28120 | |
| <I/σ(I)> | 18.1 | 3 |
| Completeness [%] | 100.0 | 100 |
| Redundancy | 9.8 | 10 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, SITTING DROP | 7 | 298 | 2 M sodium malonate |
