Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | APS BEAMLINE 24-ID-C |
Synchrotron site | APS |
Beamline | 24-ID-C |
Temperature [K] | 100 |
Detector technology | PIXEL |
Collection date | 2015-06-13 |
Detector | PSI PILATUS 6M |
Wavelength(s) | 0.9792 |
Spacegroup name | C 1 2 1 |
Unit cell lengths | 169.346, 41.795, 146.968 |
Unit cell angles | 90.00, 92.26, 90.00 |
Refinement procedure
Resolution | 18.000 - 2.900 |
R-factor | 0.20387 |
Rwork | 0.201 |
R-free | 0.25264 |
Structure solution method | MOLECULAR REPLACEMENT |
RMSD bond length | 0.017 |
RMSD bond angle | 1.989 |
Data reduction software | HKL-2000 |
Data scaling software | HKL-2000 |
Phasing software | PHASER |
Refinement software | REFMAC (5.8.0189) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 18.000 | 3.000 |
High resolution limit [Å] | 2.900 | 2.900 |
Rmerge | 0.080 | 0.960 |
Number of reflections | 21636 | |
<I/σ(I)> | 23 | |
Completeness [%] | 92.9 | 95.6 |
Redundancy | 3.3 | 3.1 |
CC(1/2) | 1.000 | 0.210 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | MICROBATCH | 298 | 100 mM MIB (Qiagen), pH 9.0, 25% PEG1500 |