4UIQ
Isolated globin domain of the Bordetella pertussis globin-coupled sensor with a heme at the dimer interface
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | ESRF BEAMLINE ID23-1 |
| Synchrotron site | ESRF |
| Beamline | ID23-1 |
| Temperature [K] | 100 |
| Detector technology | PIXEL |
| Collection date | 2013-09-15 |
| Detector | DECTRIS PILATUS 6M |
| Spacegroup name | C 1 2 1 |
| Unit cell lengths | 69.960, 53.110, 81.170 |
| Unit cell angles | 90.00, 93.23, 90.00 |
Refinement procedure
| Resolution | 40.521 - 1.550 |
| R-factor | 0.1581 |
| Rwork | 0.156 |
| R-free | 0.20430 |
| Structure solution method | SAD |
| Starting model (for MR) | NONE |
| RMSD bond length | 0.017 |
| RMSD bond angle | 1.814 |
| Data reduction software | MOSFLM |
| Data scaling software | SCALA |
| Phasing software | SOLVE |
| Refinement software | PHENIX ((PHENIX.REFINE)) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 42.280 | 1.630 |
| High resolution limit [Å] | 1.550 | 1.550 |
| Rmerge | 0.070 | 0.500 |
| Number of reflections | 42168 | |
| <I/σ(I)> | 9.8 | 2.7 |
| Completeness [%] | 97.6 | 97.5 |
| Redundancy | 3.5 | 3.5 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | 0.8 - 1 M AMMONIUM SULPHATE, 0.1 M TRIS-HCL PH 6.0 - 9.0 |
