3C1L
Crystal structure of an antioxidant defense protein (mlr4105) from mesorhizobium loti maff303099 at 2.00 A resolution
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | SSRL BEAMLINE BL11-1 |
Synchrotron site | SSRL |
Beamline | BL11-1 |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2007-02-11 |
Detector | MARMOSAIC 325 mm CCD |
Wavelength(s) | 0.91837 |
Spacegroup name | P 1 21 1 |
Unit cell lengths | 65.690, 68.060, 266.830 |
Unit cell angles | 90.00, 95.94, 90.00 |
Refinement procedure
Resolution | 29.814 - 2.000 |
R-factor | 0.174 |
Rwork | 0.171 |
R-free | 0.22500 |
Structure solution method | SAD + MOLECULAR REPLACEMENT |
RMSD bond length | 0.016 |
RMSD bond angle | 1.498 |
Data reduction software | XDS |
Data scaling software | XSCALE |
Phasing software | SHARP |
Refinement software | REFMAC (5.4.0066) |
Data quality characteristics
Overall | Inner shell | Outer shell | |
Low resolution limit [Å] | 29.814 | 29.814 | 2.070 |
High resolution limit [Å] | 2.000 | 4.300 | 2.000 |
Rmerge | 0.058 | 0.028 | 0.354 |
Number of reflections | 138837 | 29561 | 12737 |
<I/σ(I)> | 7.38 | 16.7 | 1.6 |
Completeness [%] | 84.6 | 94.6 | 41.9 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, SITTING DROP | 8 | 277 | NANODROP, 20.0% PEG 6000, 0.1M Tris-HCl pH 8.0, VAPOR DIFFUSION, SITTING DROP, temperature 277K |
2 | VAPOR DIFFUSION, SITTING DROP | 6.2 | 277 | NANODROP, 0.2M NaCl, 50.0% PEG 200, 0.1M Na,K Phosphate pH 6.2, VAPOR DIFFUSION, SITTING DROP, temperature 277K |