6IHW
Crystal structure of bacterial serine phosphatase bearing R161K mutation
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | SSRF BEAMLINE BL19U1 |
| Synchrotron site | SSRF |
| Beamline | BL19U1 |
| Temperature [K] | 100 |
| Detector technology | PIXEL |
| Collection date | 2017-11-29 |
| Detector | DECTRIS PILATUS 6M |
| Wavelength(s) | 0.9375 |
| Spacegroup name | P 1 21 1 |
| Unit cell lengths | 46.578, 38.958, 65.409 |
| Unit cell angles | 90.00, 102.08, 90.00 |
Refinement procedure
| Resolution | 29.606 - 1.550 |
| R-factor | 0.1522 |
| Rwork | 0.151 |
| R-free | 0.17410 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 5f1m |
| RMSD bond length | 0.009 |
| RMSD bond angle | 0.977 |
| Data reduction software | HKL-3000 |
| Data scaling software | HKL-3000 |
| Phasing software | PHASER |
| Refinement software | PHENIX ((1.10.1_2155: ???)) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 30.000 | 1.610 |
| High resolution limit [Å] | 1.550 | 1.550 |
| Rmerge | 0.089 | 0.198 |
| Number of reflections | 32616 | 3033 |
| <I/σ(I)> | 12.7 | |
| Completeness [%] | 97.4 | |
| Redundancy | 4.4 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, SITTING DROP | 289 | 0.05 M MgCl2, 0.1 M HEPES (pH=7.5), 30% PEG 3350. |
