6H1C
Structure of Ferric uptake regulator from Pseudomonas aeruginosa with manganese.
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | ESRF BEAMLINE BM30A |
| Synchrotron site | ESRF |
| Beamline | BM30A |
| Temperature [K] | 80 |
| Detector technology | PIXEL |
| Collection date | 2016-07-21 |
| Detector | DECTRIS PILATUS3 R CdTe 300K-W |
| Wavelength(s) | 0.96, 1.29 |
| Spacegroup name | P 61 2 2 |
| Unit cell lengths | 85.570, 85.570, 179.620 |
| Unit cell angles | 90.00, 90.00, 120.00 |
Refinement procedure
| Resolution | 46.120 - 2.340 |
| R-factor | 0.2041 |
| Rwork | 0.201 |
| R-free | 0.26810 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 1mzb |
| RMSD bond length | 0.008 |
| RMSD bond angle | 0.861 |
| Data reduction software | XDS |
| Data scaling software | XSCALE |
| Phasing software | SHELXS |
| Refinement software | PHENIX ((1.10.1_2155: ???)) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 46.120 | 2.278 |
| High resolution limit [Å] | 2.199 | 2.199 |
| Number of reflections | 20008 | |
| <I/σ(I)> | 7.61 | |
| Completeness [%] | 99.7 | |
| Redundancy | 3 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 6 | 293.15 | 100mM MES pH 6 10mM MnCl2 20% PEG 8000 |
