Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | APS BEAMLINE 17-ID |
Synchrotron site | APS |
Beamline | 17-ID |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2006-02-20 |
Detector | ADSC QUANTUM 210 |
Wavelength(s) | 1.00003 |
Spacegroup name | P 1 |
Unit cell lengths | 93.057, 106.058, 114.932 |
Unit cell angles | 70.12, 84.57, 68.61 |
Refinement procedure
Resolution | 40.000 - 2.100 |
R-factor | 0.203 |
Rwork | 0.202 |
R-free | 0.23620 |
Starting model (for MR) | 2GL6 |
RMSD bond length | 0.014 |
RMSD bond angle | 1.267 |
Data scaling software | Aimless (0.5.1) |
Refinement software | REFMAC |
Data quality characteristics
Overall | Inner shell | Outer shell | |
Low resolution limit [Å] | 49.090 | 49.090 | 2.030 |
High resolution limit [Å] | 2.000 | 10.950 | 2.000 |
Rmerge | 0.077 | 0.019 | 0.897 |
Rpim | 0.077 | 0.019 | 0.894 |
Total number of observations | 494536 | 2735 | 24658 |
Number of reflections | 247985 | ||
<I/σ(I)> | 8.5 | 36 | 1 |
Completeness [%] | 95.4 | 90.3 | 95.5 |
Redundancy | 2 | 1.9 | 2 |
CC(1/2) | 0.995 | 0.998 | 0.318 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, SITTING DROP | 6 | 291 | 17% PEG-3350, 10mM DTT, 0.2M diammonium citrate, 0.1M Bis-TRIS, protein buffer also contained magnesium chloride, creatine, ADP |