Experimental procedure
Experimental method | MAD |
Source type | SYNCHROTRON |
Source details | NSLS BEAMLINE X6A |
Synchrotron site | NSLS |
Beamline | X6A |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2007-10-13 |
Detector | ADSC QUANTUM 4 |
Wavelength(s) | 1.0072, 1.0090 |
Spacegroup name | F 4 3 2 |
Unit cell lengths | 233.791, 233.791, 233.791 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 50.000 - 3.100 |
Rwork | 0.194 |
R-free | 0.25800 |
Structure solution method | MAD |
RMSD bond length | 0.008 |
RMSD bond angle | 1.480 |
Data reduction software | HKL-2000 |
Data scaling software | SCALEPACK |
Phasing software | SOLVE |
Refinement software | CNS |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 50.000 | 3.210 |
High resolution limit [Å] | 3.100 | 3.100 |
Number of reflections | 18820 | |
<I/σ(I)> | 51.1 | 14.5 |
Completeness [%] | 100.0 | 100 |
Redundancy | 45.5 | 44.9 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 7.5 | 298 | reservoir solution contains 12.5% (v/v) PEG4000, 100 mM Hepes. Protein (10 mg/ml) in 20 mM Hepes, 150 mM NaCl, and 5 mM BME, pH 7.5, VAPOR DIFFUSION, HANGING DROP, temperature 298K |