Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | ALS BEAMLINE 5.0.2 |
Synchrotron site | ALS |
Beamline | 5.0.2 |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2014-09-10 |
Detector | ADSC QUANTUM 315r |
Wavelength(s) | 1.0 |
Spacegroup name | P 21 21 21 |
Unit cell lengths | 55.325, 90.127, 123.185 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 72.740 - 2.440 |
R-factor | 0.1888 |
Rwork | 0.186 |
R-free | 0.24050 |
Structure solution method | MOLECULAR REPLACEMENT |
RMSD bond length | 0.010 |
RMSD bond angle | 1.130 |
Data reduction software | XDS |
Data scaling software | XSCALE |
Phasing software | PHASER |
Refinement software | BUSTER (2.11.5) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 90.000 | 2.570 |
High resolution limit [Å] | 2.440 | 2.440 |
Rmerge | 0.075 | 0.802 |
Number of reflections | 23645 | |
<I/σ(I)> | 18.1 | 2.4 |
Completeness [%] | 100.0 | 100 |
Redundancy | 7.1 | 7.3 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 7 | 277 | 0.1 M HEPES, pH 7.0, 10-13% PEG8000, 2 mM calcium acetate |