4H2U
Crystal structure of Bradyrhizobium japonicum glycine:[carrier protein] ligase complexed with cognate carrier protein and ATP
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | ESRF BEAMLINE BM14 |
Synchrotron site | ESRF |
Beamline | BM14 |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2011-02-26 |
Detector | MARMOSAIC 225 mm CCD |
Wavelength(s) | 0.953720 |
Spacegroup name | P 21 21 21 |
Unit cell lengths | 90.709, 100.904, 104.266 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 46.320 - 2.100 |
R-factor | 0.1771 |
Rwork | 0.175 |
R-free | 0.20940 |
Structure solution method | FOURIER SYNTHESIS |
RMSD bond length | 0.007 |
RMSD bond angle | 1.105 |
Data reduction software | XDS |
Data scaling software | XSCALE |
Phasing software | PHENIX |
Refinement software | PHENIX (dev_1116) |
Data quality characteristics
Overall | Inner shell | Outer shell | |
Low resolution limit [Å] | 46.320 | 46.320 | 2.220 |
High resolution limit [Å] | 2.100 | 6.240 | 2.100 |
Rmerge | 0.063 | 0.024 | 0.495 |
Number of reflections | 56605 | 2335 | 8924 |
<I/σ(I)> | 22.41 | 57.83 | 4.43 |
Completeness [%] | 99.7 | 99.5 | 98.4 |
Redundancy | 7.2 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 6.5 | 291 | 25.5% PEG 8000, 0.17M ammonium sulfate, 0.085 M sodium cacodylate pH 6.5, 15% glycerol, VAPOR DIFFUSION, HANGING DROP, temperature 291K |