Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | APS BEAMLINE 23-ID-B |
Synchrotron site | APS |
Beamline | 23-ID-B |
Temperature [K] | 90 |
Detector technology | CCD |
Collection date | 2014-12-06 |
Detector | MARMOSAIC 300 mm CCD |
Wavelength(s) | 0.920 |
Spacegroup name | I 2 2 2 |
Unit cell lengths | 157.400, 160.870, 167.350 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 15.000 - 3.750 |
R-factor | 0.231 |
Rwork | 0.228 |
R-free | 0.28000 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 4lto |
Data reduction software | iMOSFLM |
Data scaling software | SCALA |
Phasing software | PHASER |
Refinement software | REFMAC (5.6.0117) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 15.000 | |
High resolution limit [Å] | 3.750 | 3.750 |
Number of reflections | 21081 | |
<I/σ(I)> | 5.4 | |
Completeness [%] | 99.1 | |
Redundancy | 4.9 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 5.25 | 277 | 100 mM sodium acetate, pH 5.25, 30% PEG300 |