3BRT
NEMO/IKK association domain structure
Experimental procedure
Experimental method | MAD |
Source type | SYNCHROTRON |
Source details | NSLS BEAMLINE X25 |
Synchrotron site | NSLS |
Beamline | X25 |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2005-04-12 |
Detector | ADSC QUANTUM 315 |
Wavelength(s) | 0.9794,0.9799 |
Spacegroup name | P 21 21 21 |
Unit cell lengths | 41.869, 105.556, 56.707 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 38.900 - 2.250 |
R-factor | 0.23961 |
Rwork | 0.238 |
R-free | 0.28186 |
Structure solution method | MAD |
RMSD bond length | 0.022 |
RMSD bond angle | 1.928 |
Data reduction software | HKL-2000 |
Data scaling software | HKL-2000 |
Phasing software | PHASER |
Refinement software | REFMAC (5.2.0019) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 38.900 | 2.330 |
High resolution limit [Å] | 2.250 | 2.250 |
Rmerge | 0.072 | 0.396 |
Number of reflections | 11760 | |
<I/σ(I)> | 1.7 | |
Completeness [%] | 93.4 | 69.4 |
Redundancy | 7.9 | 1.7 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | microbatch under oil | 8 | 298 | 35% Peg 8K, 0.1M Tris pH 8, 0.2M Ammonium Chloride, 10mM Dithiothreitol., microbatch under oil, temperature 298K |