5HDP
Hydrolase StnA mutant - S185A
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | SSRF BEAMLINE BL17U |
| Synchrotron site | SSRF |
| Beamline | BL17U |
| Temperature [K] | 100 |
| Detector technology | CCD |
| Collection date | 2015-05-31 |
| Detector | RAYONIX MX-225 |
| Wavelength(s) | 0.9818 |
| Spacegroup name | P 1 |
| Unit cell lengths | 83.256, 92.847, 104.037 |
| Unit cell angles | 115.06, 106.09, 97.69 |
Refinement procedure
| Resolution | 46.072 - 2.900 |
| R-factor | 0.24637 |
| Rwork | 0.244 |
| R-free | 0.29760 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 5hdf |
| RMSD bond length | 0.010 |
| RMSD bond angle | 1.370 |
| Data reduction software | HKL-2000 |
| Data scaling software | HKL-2000 |
| Phasing software | MOLREP |
| Refinement software | REFMAC (5.8.0103) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 50.000 | 3.000 |
| High resolution limit [Å] | 2.900 | 2.900 |
| Rmerge | 0.487 | |
| Number of reflections | 57747 | |
| <I/σ(I)> | 6.12 | 2.54 |
| Completeness [%] | 95.8 | 96.6 |
| Redundancy | 3.2 | 3.2 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 287 | 0.1 M Ammonium Citrate dibasic, 0.1 M Sodium citrate pH 5.0, 20% 2-propanol, 15% PEG 3350 |
