9P1A
B. pseudomallei rubrerythrin room temperature structure from LEAP-X device
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | SSRL BEAMLINE BL9-2 |
| Synchrotron site | SSRL |
| Beamline | BL9-2 |
| Temperature [K] | 293 |
| Detector technology | PIXEL |
| Collection date | 2024-06-07 |
| Detector | DECTRIS EIGER X 16M |
| Wavelength(s) | 0.97946 |
| Spacegroup name | H 3 |
| Unit cell lengths | 203.442, 203.442, 71.077 |
| Unit cell angles | 90.00, 90.00, 120.00 |
Refinement procedure
| Resolution | 30.150 - 1.960 |
| R-factor | 0.1679 |
| Rwork | 0.167 |
| R-free | 0.21270 |
| Structure solution method | MOLECULAR REPLACEMENT |
| RMSD bond length | 0.009 |
| RMSD bond angle | 0.976 |
| Data reduction software | xia2.multiplex |
| Data scaling software | DIALS |
| Phasing software | MOLREP |
| Refinement software | PHENIX (1.21.2_5419) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 30.150 | 1.990 |
| High resolution limit [Å] | 1.960 | 1.960 |
| Rmerge | 0.120 | |
| Rpim | 0.104 | |
| Number of reflections | 126777 | 3696 |
| <I/σ(I)> | 5.8 | 0.4 |
| Completeness [%] | 95.8 | |
| Redundancy | 2.2 | |
| CC(1/2) | 0.945 | 0.257 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | MICROFLUIDIC | 293 | 0.1 M HEPES pH 7.6, 0.1 M Li2SO4, 23% PEG 20,000 |
