Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | SLS BEAMLINE X06SA |
Synchrotron site | SLS |
Beamline | X06SA |
Temperature [K] | 100 |
Detector technology | PIXEL |
Collection date | 2013-03-19 |
Detector | DECTRIS PILATUS 6M |
Wavelength(s) | 1.000 |
Spacegroup name | P 21 21 21 |
Unit cell lengths | 210.200, 448.800, 621.000 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 153.410 - 3.300 |
Rwork | 0.191 |
R-free | 0.25780 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 3TVE 3TVF |
Data reduction software | XDS |
Data scaling software | XSCALE |
Phasing software | PHASER |
Refinement software | PHENIX |
Data quality characteristics
Overall | Inner shell | Outer shell | |
Low resolution limit [Å] | 300.000 | 3.400 | |
High resolution limit [Å] | 3.300 | 100.000 | 3.300 |
Rmerge | 0.459 | 0.071 | 3.698 |
Rmeas | 0.465 | 0.079 | 3.795 |
Total number of observations | 35911012 | ||
Number of reflections | 871092 | 13 | 74101 |
<I/σ(I)> | 9.41 | 18.48 | 0.99 |
Completeness [%] | 99.9 | 28.3 | 99.9 |
Redundancy | 41.2 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, SITTING DROP | 7 | 298 | Tris-acetate, KSCN, PEG 550MME, PEG 20K |