6AH7
D45W/H226G mutant of marine bacterial prolidase
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | SSRF BEAMLINE BL17B1 |
| Synchrotron site | SSRF |
| Beamline | BL17B1 |
| Temperature [K] | 95 |
| Detector technology | PIXEL |
| Collection date | 2018-06-16 |
| Detector | DECTRIS EIGER X 16M |
| Wavelength(s) | 0.97918 |
| Spacegroup name | H 3 2 |
| Unit cell lengths | 183.632, 183.632, 371.306 |
| Unit cell angles | 90.00, 90.00, 120.00 |
Refinement procedure
| Resolution | 67.290 - 2.380 |
| Rwork | 0.233 |
| R-free | 0.26930 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 4zwo |
| RMSD bond length | 0.004 |
| RMSD bond angle | 0.641 |
| Data reduction software | XDS |
| Data scaling software | XDS |
| Phasing software | PHASER |
| Refinement software | PHENIX ((1.13_2998: ???)) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 67.290 | 2.500 |
| High resolution limit [Å] | 2.380 | 2.380 |
| Rmerge | 0.198 | 1.498 |
| Number of reflections | 94764 | 14041 |
| <I/σ(I)> | 12.5 | 2.4 |
| Completeness [%] | 97.8 | 100 |
| Redundancy | 19.8 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 293 | 2 M Ammonium sulfate, 5% PEG400, 100 mM MES pH6.5 |
