4RNI
PaMorA dimeric phosphodiesterase. apo form
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | DIAMOND BEAMLINE I04 |
| Synchrotron site | Diamond |
| Beamline | I04 |
| Temperature [K] | 100 |
| Detector technology | PIXEL |
| Detector | DECTRIS PILATUS 6M-F |
| Wavelength(s) | 0.97949 |
| Spacegroup name | P 2 21 21 |
| Unit cell lengths | 35.754, 94.466, 154.703 |
| Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
| Resolution | 80.620 - 2.170 |
| R-factor | 0.1851 |
| Rwork | 0.181 |
| R-free | 0.23770 |
| Structure solution method | MOLECULAR REPLACEMENT |
| RMSD bond length | 0.014 |
| RMSD bond angle | 1.479 |
| Data reduction software | xia2 |
| Data scaling software | SCALA |
| Phasing software | MOLREP |
| Refinement software | REFMAC (5.8.0049) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 80.620 | 2.230 |
| High resolution limit [Å] | 2.170 | 2.170 |
| Rmerge | 0.110 | 0.808 |
| Number of reflections | 28802 | |
| <I/σ(I)> | 18.3 | 3.8 |
| Completeness [%] | 100.0 | 100 |
| Redundancy | 13.3 | 13.9 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, SITTING DROP | 5.5 | 295 | 0.2M magnesium chloride, 0.1M Bis Tris, 25% PEG 3350 , pH 5.5, VAPOR DIFFUSION, SITTING DROP, temperature 295K |
