5M42
Structure of Thermus thermophilus L-proline dehydrogenase lacking alpha helices A, B and C
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | DIAMOND BEAMLINE I02 |
| Synchrotron site | Diamond |
| Beamline | I02 |
| Temperature [K] | 100 |
| Detector technology | PIXEL |
| Collection date | 2015-05-14 |
| Detector | DECTRIS PILATUS 6M-F |
| Wavelength(s) | 0.97949 |
| Spacegroup name | P 62 |
| Unit cell lengths | 131.920, 131.920, 36.580 |
| Unit cell angles | 90.00, 90.00, 120.00 |
Refinement procedure
| Resolution | 60.010 - 2.200 |
| R-factor | 0.18454 |
| Rwork | 0.182 |
| R-free | 0.22484 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 2g37 |
| RMSD bond length | 0.019 |
| RMSD bond angle | 2.081 |
| Data reduction software | XDS |
| Data scaling software | SCALA |
| Phasing software | MOLREP |
| Refinement software | REFMAC (5.8.0103) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 65.960 | 2.320 |
| High resolution limit [Å] | 2.200 | 2.200 |
| Rmerge | 0.139 | |
| Number of reflections | 18892 | |
| <I/σ(I)> | 10.9 | |
| Completeness [%] | 100.0 | 100 |
| Redundancy | 8.4 | 8.7 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, SITTING DROP | 4.6 | 291 | 20 % v/v 2-propanol, 0.2 M calcium chloride dihydrate and 0.1 M sodium acetate pH 4.6 |
