5DPD
The structure of PKMT1 from Rickettsia prowazekii in complex with AdoMet
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | APS BEAMLINE 23-ID-D |
| Synchrotron site | APS |
| Beamline | 23-ID-D |
| Temperature [K] | 100 |
| Detector technology | IMAGE PLATE |
| Collection date | 2012-10-31 |
| Detector | MAR scanner 300 mm plate |
| Wavelength(s) | 1.0 |
| Spacegroup name | P 1 21 1 |
| Unit cell lengths | 98.033, 62.935, 107.632 |
| Unit cell angles | 90.00, 100.42, 90.00 |
Refinement procedure
| Resolution | 48.207 - 3.000 |
| R-factor | 0.1996 |
| Rwork | 0.197 |
| R-free | 0.23360 |
| RMSD bond length | 0.007 |
| RMSD bond angle | 1.245 |
| Data reduction software | HKL-2000 |
| Refinement software | PHENIX |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 50.000 | 3.110 |
| High resolution limit [Å] | 3.000 | 3.000 |
| Rmerge | 0.520 | |
| Number of reflections | 25149 | |
| <I/σ(I)> | 8.4 | 1.5 |
| Completeness [%] | 95.0 | 89.7 |
| Redundancy | 2.4 | 2 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 294 | 4 % v/v isopropanol, 0.1 M Bis-Tris propane, pH 9.0, 20% w/v polyethylene glycol monomethyl ether 5000 |
