4RNF
PaMorA tandem diguanylate cyclase - mutant phosphodiesterase, apo form
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | DIAMOND BEAMLINE I03 |
| Synchrotron site | Diamond |
| Beamline | I03 |
| Temperature [K] | 100 |
| Detector technology | PIXEL |
| Collection date | 2013-07-27 |
| Detector | DECTRIS PILATUS 6M |
| Spacegroup name | P 1 |
| Unit cell lengths | 40.744, 47.352, 60.010 |
| Unit cell angles | 82.15, 71.63, 70.66 |
Refinement procedure
| Resolution | 28.460 - 2.850 |
| R-factor | 0.241 |
| Rwork | 0.239 |
| R-free | 0.27800 |
| Structure solution method | MOLECULAR REPLACEMENT |
| RMSD bond length | 0.014 |
| RMSD bond angle | 1.370 |
| Data reduction software | xia2 |
| Data scaling software | Aimless (0.1.27) |
| Phasing software | MOLREP |
| Refinement software | PHENIX (1.8_1069) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 28.460 | 3.000 |
| High resolution limit [Å] | 2.850 | 2.850 |
| Rmerge | 0.174 | 0.578 |
| Number of reflections | 9235 | |
| <I/σ(I)> | 7.4 | 2.4 |
| Completeness [%] | 98.5 | 98 |
| Redundancy | 2.8 | 2.8 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | 6.5 | 295 | 0.1M Imidazole; MES, 0.12M 1,6-Hexanediol; 1-Butanol 1,2-Propanediol (racemic); 2-Propanol; 1,4-Butanediol; 1,3-Propanediol, 30% Ethylene glycol; PEG 8000, pH 6.5, VAPOR DIFFUSION, SITTING DROP, temperature 295K |
