5HDF
Hydrolase SeMet-StnA
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 | 2014-05-27 |
| Detector | RAYONIX MX-225 |
| Wavelength(s) | 0.9819 |
| Spacegroup name | C 1 2 1 |
| Unit cell lengths | 178.420, 81.970, 118.693 |
| Unit cell angles | 90.00, 126.75, 90.00 |
Refinement procedure
| Resolution | 50.000 - 2.710 |
| R-factor | 0.19366 |
| Rwork | 0.192 |
| R-free | 0.21957 |
| Structure solution method | SAD |
| RMSD bond length | 0.017 |
| RMSD bond angle | 1.250 |
| Data reduction software | HKL-2000 |
| Data scaling software | HKL-2000 |
| Phasing software | PHENIX |
| Refinement software | REFMAC (5.8.0103) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 50.000 | 2.800 |
| High resolution limit [Å] | 2.710 | 2.700 |
| Rmerge | 0.111 | 0.300 |
| Number of reflections | 37623 | |
| <I/σ(I)> | 14.55 | 6.08 |
| Completeness [%] | 99.9 | 99.9 |
| Redundancy | 3.8 | 3.8 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 5 | 287 | 30% 2-propanol, 0.1 M Sodium citrate pH 5.0,12% PEG 3350 |
