3PXT
Crystal Structure of Ferrous CO Adduct of MauG in Complex with Pre-Methylamine Dehydrogenase
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 | 2010-08-09 |
Detector | MARMOSAIC 300 mm CCD |
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 | 44.490 - 2.160 |
R-factor | 0.18 |
Rwork | 0.177 |
R-free | 0.22600 |
Structure solution method | MOLECULAR REPLACEMENT |
RMSD bond length | 0.007 |
RMSD bond angle | 1.323 |
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 | 2.200 |
High resolution limit [Å] | 2.160 | 2.160 |
Rmerge | 0.083 | 0.380 |
Number of reflections | 90587 | |
<I/σ(I)> | 9.265 | 2 |
Completeness [%] | 97.7 | 96 |
Redundancy | 1.9 | 1.9 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | 6.4 | 293 | 0.1M MES pH 6.4, 0.1M sodium acetate, 23-25 % w/v PEG 8000, vapor diffusion, hanging drop, temperature 293K, VAPOR DIFFUSION, HANGING DROP |