3EZ1
Crystal structure of putative aminotransferase (MocR family) (YP_604413.1) from DEINOCOCCUS GEOTHERMALIS DSM 11300 at 2.60 A resolution
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | SSRL BEAMLINE BL9-2 |
Synchrotron site | SSRL |
Beamline | BL9-2 |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2008-08-10 |
Detector | MARMOSAIC 325 mm CCD |
Spacegroup name | P 1 21 1 |
Unit cell lengths | 62.720, 103.969, 73.815 |
Unit cell angles | 90.00, 112.63, 90.00 |
Refinement procedure
Resolution | 30.002 - 2.600 |
R-factor | 0.226 |
Rwork | 0.224 |
R-free | 0.26400 |
Structure solution method | MR |
Starting model (for MR) | 3d6k |
RMSD bond length | 0.012 |
RMSD bond angle | 1.476 |
Data reduction software | MOSFLM |
Data scaling software | SCALA (3.2.5) |
Phasing software | PHASER |
Refinement software | REFMAC (5.2.0019) |
Data quality characteristics
Overall | Inner shell | Outer shell | |
Low resolution limit [Å] | 30.002 | 30.002 | 2.670 |
High resolution limit [Å] | 2.600 | 11.630 | 2.600 |
Rmerge | 0.186 | 0.056 | 0.630 |
Total number of observations | 850 | 5920 | |
Number of reflections | 26740 | ||
<I/σ(I)> | 6.7 | 18.6 | 2 |
Completeness [%] | 99.3 | 91.6 | 99.9 |
Redundancy | 3 | 2.9 | 3 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, SITTING DROP | 8.5 | 277 | 0.2000M MgCl2, 20.0000% PEG-8000, 0.1M TRIS pH 8.5, NANODROP, VAPOR DIFFUSION, SITTING DROP, temperature 277K |