2B4U
Structure of the C252S mutant of Selenomonas ruminantium PTP-like phytase
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | ALS BEAMLINE 8.3.1 |
| Synchrotron site | ALS |
| Beamline | 8.3.1 |
| Temperature [K] | 100 |
| Detector technology | CCD |
| Collection date | 2004-07-29 |
| Detector | ADSC QUANTUM 4 |
| Wavelength(s) | 1.0206 |
| Spacegroup name | P 1 21 1 |
| Unit cell lengths | 45.837, 137.187, 79.954 |
| Unit cell angles | 90.00, 103.53, 90.00 |
Refinement procedure
| Resolution | 40.000 - 2.000 |
| Rwork | 0.197 |
| R-free | 0.23200 |
| Structure solution method | MOLECULAR REPLACEMENT |
| RMSD bond length | 0.006 |
| RMSD bond angle | 1.054 |
| Data reduction software | DENZO |
| Data scaling software | SCALEPACK |
| Refinement software | CNS |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 50.000 | 2.070 |
| High resolution limit [Å] | 2.000 | 2.000 |
| Rmerge | 0.094 | 0.565 |
| Number of reflections | 48658 | |
| Completeness [%] | 79.0 | 64.9 |
| Redundancy | 3.1 | 2.9 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION | 6.5 | 295 | 1.35 M ammonium sulfate, 0.90 M NaCl, 1 % 1,6 hexandiol, pH 6.5, VAPOR DIFFUSION, temperature 295K |
| 1 | VAPOR DIFFUSION | 6.5 | 295 | 1.35 M ammonium sulfate, 0.90 M NaCl, 1 % 1,6 hexandiol, pH 6.5, VAPOR DIFFUSION, temperature 295K |
