5XJV
Two intermediate states of conformation switch in dual specificity phosphatase 13a
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | PAL/PLS BEAMLINE 7A (6B, 6C1) |
| Synchrotron site | PAL/PLS |
| Beamline | 7A (6B, 6C1) |
| Temperature [K] | 93 |
| Detector technology | CCD |
| Collection date | 2016-10-20 |
| Detector | ADSC QUANTUM 315 |
| Wavelength(s) | 0.97933 |
| Spacegroup name | P 1 21 1 |
| Unit cell lengths | 40.037, 89.343, 45.897 |
| Unit cell angles | 90.00, 89.88, 90.00 |
Refinement procedure
| Resolution | 45.900 - 1.690 |
| R-factor | 0.18015 |
| Rwork | 0.178 |
| R-free | 0.22057 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 2gwo |
| RMSD bond length | 0.018 |
| RMSD bond angle | 1.893 |
| Data reduction software | DENZO |
| Data scaling software | HKL-2000 |
| Phasing software | MOLREP |
| Refinement software | REFMAC (5.8.0158) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 50.000 | 1.720 |
| High resolution limit [Å] | 1.690 | 1.690 |
| Number of reflections | 35981 | |
| <I/σ(I)> | 31.5 | |
| Completeness [%] | 99.5 | |
| Redundancy | 3.7 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, SITTING DROP | 8.5 | 291 | 100 mM Tris-HCl (pH 8.5), 20% ethanol |
