4L1Q
Crystal Structure of the E113Q-MauG/pre-Methylamine Dehydrogenase Complex
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 | CCD |
| Collection date | 2011-07-28 |
| Detector | MARMOSAIC 300 mm CCD |
| Wavelength(s) | 1.03313 |
| Spacegroup name | P 1 |
| Unit cell lengths | 55.530, 83.520, 107.780 |
| Unit cell angles | 109.94, 91.54, 105.78 |
Refinement procedure
| Resolution | 24.350 - 1.920 |
| R-factor | 0.16279 |
| Rwork | 0.160 |
| R-free | 0.20714 |
| Starting model (for MR) | 3l4m |
| RMSD bond length | 0.020 |
| RMSD bond angle | 2.161 |
| Data reduction software | HKL-2000 |
| Data scaling software | HKL-2000 |
| Phasing software | REFMAC (5.7.0029) |
| Refinement software | REFMAC (5.7.0029) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 25.000 | 1.950 |
| High resolution limit [Å] | 1.920 | 1.920 |
| Rmerge | 0.066 | 0.482 |
| Number of reflections | 122656 | |
| <I/σ(I)> | 19.79 | 3.37 |
| Completeness [%] | 97.5 | 96.4 |
| Redundancy | 4.4 | 4.4 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 6.4 | 293 | 0.1M MES pH 6.4, 0.1M sodium acetate, 24-30% w/v PEG 8000, VAPOR DIFFUSION, HANGING DROP, temperature 293K |
