3PU9
Crystal structure of serine/threonine phosphatase Sphaerobacter thermophilus DSM 20745
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | APS BEAMLINE 19-ID |
| Synchrotron site | APS |
| Beamline | 19-ID |
| Temperature [K] | 100 |
| Detector technology | CCD |
| Collection date | 2010-10-23 |
| Detector | ADSC QUANTUM 315r |
| Wavelength(s) | 0.9794 |
| Spacegroup name | P 1 21 1 |
| Unit cell lengths | 60.168, 54.713, 63.262 |
| Unit cell angles | 90.00, 99.51, 90.00 |
Refinement procedure
| Resolution | 40.000 - 1.550 |
| R-factor | 0.17987 |
| Rwork | 0.178 |
| R-free | 0.21688 |
| Structure solution method | SAD |
| RMSD bond length | 0.022 |
| RMSD bond angle | 1.769 |
| Data reduction software | HKL-3000 |
| Data scaling software | HKL-3000 |
| Phasing software | HKL-3000 |
| Refinement software | REFMAC (5.5.0109) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 40.000 | 1.580 |
| High resolution limit [Å] | 1.550 | 1.550 |
| Rmerge | 0.080 | |
| Number of reflections | 58016 | |
| <I/σ(I)> | 26 | |
| Completeness [%] | 98.3 | 97.3 |
| Redundancy | 4.2 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, SITTING DROP | 9.5 | 297 | 30% pag 400, 0.1 Ches, pH 9.5, VAPOR DIFFUSION, SITTING DROP, temperature 297K |
