3SJL
Crystal Structure of the P107S-MauG/pre-Methylamine Dehydrogenase Complex
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | APS BEAMLINE 23-ID-B |
| Synchrotron site | APS |
| Beamline | 23-ID-B |
| Temperature [K] | 100 |
| Detector technology | CCD |
| Collection date | 2011-03-30 |
| Detector | MARMOSAIC 300 mm CCD |
| Wavelength(s) | 1.03320 |
| Spacegroup name | P 1 |
| Unit cell lengths | 55.606, 89.001, 104.812 |
| Unit cell angles | 67.05, 79.51, 79.72 |
Refinement procedure
| Resolution | 29.390 - 1.630 |
| R-factor | 0.14386 |
| Rwork | 0.142 |
| R-free | 0.17952 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 3l4m |
| RMSD bond length | 0.028 |
| RMSD bond angle | 2.354 |
| Data reduction software | HKL-2000 |
| Data scaling software | HKL-2000 |
| Phasing software | REFMAC (5.5.0109) |
| Refinement software | REFMAC (5.5.0109) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 50.000 | 1.660 |
| High resolution limit [Å] | 1.630 | 1.630 |
| Number of reflections | 208546 | |
| <I/σ(I)> | 24.2 | 2.9 |
| Completeness [%] | 92.5 | 58.6 |
| Redundancy | 3.7 | 2.6 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 6.4 | 293 | Drops contained 1uL protein with 3uL reservoir solution. Protein solution: 100uM P107S-MauG and 50uM preMADH in 10mM potassium phosphate pH 7.5. Reservoir solution contained: 22% w/v PEG 8000, 0.1M sodium acetate, 0.1M MES pH 6.4., VAPOR DIFFUSION, HANGING DROP, temperature 293K |
