5NLY
Brag2 Sec7-PH (390-763), P212121
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | ESRF BEAMLINE ID23-2 |
Synchrotron site | ESRF |
Beamline | ID23-2 |
Temperature [K] | 100 |
Detector technology | PIXEL |
Collection date | 2016-07-11 |
Detector | DECTRIS PILATUS 2M |
Wavelength(s) | 0.872899 |
Spacegroup name | P 21 21 21 |
Unit cell lengths | 63.893, 66.039, 206.880 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 28.990 - 2.000 |
R-factor | 0.209 |
Rwork | 0.208 |
R-free | 0.23300 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 5nlv |
RMSD bond length | 0.012 |
RMSD bond angle | 1.230 |
Data reduction software | XDS |
Data scaling software | Aimless |
Refinement software | BUSTER (2.10.2) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 28.990 | 2.050 |
High resolution limit [Å] | 2.000 | 2.000 |
Rpim | 0.050 | 0.860 |
Number of reflections | 60129 | |
<I/σ(I)> | 10.1 | 1.8 |
Completeness [%] | 99.7 | |
Redundancy | 5.9 | 5.4 |
CC(1/2) | 0.997 | 0.439 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 293 | 15% PEG20000, O.1M Tris pH=8.5 |