1R2K
Crystal structure of MoaB from Escherichia coli
Experimental procedure
Experimental method | MAD |
Source type | SYNCHROTRON |
Source details | MPG/DESY, HAMBURG BEAMLINE BW6 |
Synchrotron site | MPG/DESY, HAMBURG |
Beamline | BW6 |
Temperature [K] | 100 |
Detector technology | CCD |
Detector | MARRESEARCH |
Wavelength(s) | 0.9792, 0.97976, 1.2 |
Spacegroup name | P 3 2 1 |
Unit cell lengths | 69.881, 69.881, 126.912 |
Unit cell angles | 90.00, 90.00, 120.00 |
Refinement procedure
Resolution | 10.000 - 2.100 |
R-factor | 0.208 |
Rwork | 0.208 |
R-free | 0.25000 |
Structure solution method | MAD |
RMSD bond length | 0.010 |
RMSD bond angle | 1.483 |
Data reduction software | DENZO |
Data scaling software | SCALEPACK |
Phasing software | SHARP |
Refinement software | CNS (1.0) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 20.000 | 2.170 |
High resolution limit [Å] | 2.100 | 2.100 |
Number of reflections | 21683 | |
<I/σ(I)> | 12.1 | |
Completeness [%] | 98.3 | 93.7 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, SITTING DROP | 5.6 | 293 | lithium sulfate, ammonium sulfate, citrate, pH 5.6, VAPOR DIFFUSION, SITTING DROP, temperature 293K |