7K9B
Crystal structure of Bacillus halodurans OapB (native) at 1.2 A
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | APS BEAMLINE 24-ID-E |
| Synchrotron site | APS |
| Beamline | 24-ID-E |
| Temperature [K] | 100 |
| Detector technology | PIXEL |
| Collection date | 2019-08-16 |
| Detector | DECTRIS EIGER X 16M |
| Wavelength(s) | 0.97918 |
| Spacegroup name | P 1 21 1 |
| Unit cell lengths | 47.918, 34.909, 49.811 |
| Unit cell angles | 90.00, 90.24, 90.00 |
Refinement procedure
| Resolution | 47.918 - 1.202 |
| R-factor | 0.1222 |
| Rwork | 0.121 |
| R-free | 0.15110 |
| Structure solution method | SIRAS |
| Data reduction software | XDS |
| Data scaling software | XDS |
| Phasing software | AutoSol |
| Refinement software | PHENIX (1.16_3549) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 47.960 | 1.250 |
| High resolution limit [Å] | 1.200 | 1.200 |
| Rmerge | 0.034 | 0.156 |
| Rmeas | 0.041 | 0.191 |
| Rpim | 0.022 | 0.109 |
| Number of reflections | 50673 | 4791 |
| <I/σ(I)> | 17.8 | 5.1 |
| Completeness [%] | 98.4 | 93 |
| Redundancy | 3.3 | 2.8 |
| CC(1/2) | 0.999 | 0.973 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, SITTING DROP | 8.5 | 292 | 50 mM Tris-HCl (pH 8.5), 100 mM KCl, 10 mM MgCl2 and 30% polyethylene glycol (PEG) 400 |
