Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | SLS BEAMLINE X06DA |
Synchrotron site | SLS |
Beamline | X06DA |
Temperature [K] | 100 |
Detector technology | PIXEL |
Collection date | 2012-03-29 |
Detector | DECTRIS PILATUS 2M |
Wavelength(s) | 1.6 |
Spacegroup name | P 21 21 21 |
Unit cell lengths | 57.630, 85.710, 108.530 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 47.824 - 2.500 |
R-factor | 0.200698514255 |
Rwork | 0.198 |
R-free | 0.24490 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 4p9r |
RMSD bond length | 0.002 |
RMSD bond angle | 0.521 |
Data reduction software | XDS |
Data scaling software | XDS |
Phasing software | SHELX |
Refinement software | PHENIX (1.11rc1_2513) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 47.830 | 2.589 |
High resolution limit [Å] | 2.500 | 2.500 |
Number of reflections | 34663 | |
<I/σ(I)> | 3.16 | |
Completeness [%] | 96.5 | |
Redundancy | 7 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, SITTING DROP | 293 | 0.2 Sodium chloride, 0.1 M BIS-TRIS pH 6.5, 25% w/v PEG 3,350 or (ii) 0.2 Sodium chloride, 0.1 M HEPES pH 7.5, 25% w/v PEG 3,350 |