9Y0M
Crystal structure of Escherichia coli DsbA P151T mutant
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | AUSTRALIAN SYNCHROTRON BEAMLINE MX2 |
| Synchrotron site | Australian Synchrotron |
| Beamline | MX2 |
| Temperature [K] | 100 |
| Detector technology | PIXEL |
| Collection date | 2024-02-28 |
| Detector | DECTRIS EIGER X 16M |
| Wavelength(s) | 0.95373 |
| Spacegroup name | P 1 21 1 |
| Unit cell lengths | 63.762, 79.750, 103.893 |
| Unit cell angles | 90.00, 90.19, 90.00 |
Refinement procedure
| Resolution | 44.950 - 2.880 |
| R-factor | 0.2118 |
| Rwork | 0.209 |
| R-free | 0.26820 |
| Structure solution method | MOLECULAR REPLACEMENT |
| RMSD bond length | 0.003 |
| RMSD bond angle | 0.451 |
| Data reduction software | XDS |
| Data scaling software | Aimless |
| Phasing software | PHASER |
| Refinement software | PHENIX (1.21.2_5419) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 44.950 | 3.060 |
| High resolution limit [Å] | 2.880 | 2.880 |
| Rmerge | 0.176 | 1.266 |
| Rmeas | 0.191 | 1.370 |
| Rpim | 0.072 | 0.517 |
| Number of reflections | 45562 | 3629 |
| <I/σ(I)> | 7.2 | 7.2 |
| Completeness [%] | 99.1 | 99.5 |
| Redundancy | 6.9 | 6.8 |
| CC(1/2) | 0.996 | 0.710 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 293 | 1 M Ammonium sulphate 25% PEG 8000 |
