Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | ALS BEAMLINE 8.2.2 |
Synchrotron site | ALS |
Beamline | 8.2.2 |
Temperature [K] | 200 |
Detector technology | CCD |
Collection date | 2003-07-20 |
Detector | ADSC QUANTUM 4 |
Spacegroup name | P 42 21 2 |
Unit cell lengths | 100.120, 100.120, 30.090 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 10.000 - 1.600 |
R-factor | 0.144 |
Rwork | 0.144 |
R-free | 0.20000 |
Structure solution method | AB INITIO |
Starting model (for MR) | 1lu4 |
RMSD bond length | 0.009 |
RMSD bond angle | 0.034 |
Data reduction software | DENZO |
Data scaling software | SCALEPACK |
Phasing software | EPMR |
Refinement software | SHELXL |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 50.000 | 1.660 |
High resolution limit [Å] | 1.600 | 1.600 |
Rmerge | 0.068 | 0.597 |
Number of reflections | 23073 | |
<I/σ(I)> | 40.68 | 3.85 |
Completeness [%] | 100.0 | 100 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | 7 | 298 | 0.1 M NA malonate ph 7.0, 2.04 M NA citrate, 5% LDAO, temperature 298K |