5DZB
6beta1
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | DIAMOND BEAMLINE I03 |
Synchrotron site | Diamond |
Beamline | I03 |
Temperature [K] | 100 |
Detector technology | PIXEL |
Collection date | 2014-02-07 |
Detector | DECTRIS PILATUS 6M-F |
Wavelength(s) | 0.97625 |
Spacegroup name | P 21 21 21 |
Unit cell lengths | 56.960, 86.530, 362.320 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 90.580 - 3.330 |
R-factor | 0.2002 |
Rwork | 0.197 |
R-free | 0.26480 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | predicted structure |
RMSD bond length | 0.009 |
RMSD bond angle | 1.425 |
Data reduction software | xia2 |
Data scaling software | xia2 |
Phasing software | PHASER |
Refinement software | PHENIX ((1.10_2155: ???)) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 90.580 | 3.420 |
High resolution limit [Å] | 3.330 | 3.330 |
Rmerge | 0.110 | 0.666 |
Number of reflections | 26271 | |
<I/σ(I)> | 11.61 | 2.88 |
Completeness [%] | 99.2 | 99.4 |
Redundancy | 7.08 | 7.17 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION | 7.5 | 290 | 20% v/v 1,4 butanediol HEPES pH 7.5, 0.2 M NaCL |