5NSF
Structure of AzuAla
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | BESSY BEAMLINE 14.1 |
Synchrotron site | BESSY |
Beamline | 14.1 |
Temperature [K] | 100 |
Detector technology | PIXEL |
Collection date | 2016-09-25 |
Detector | DECTRIS PILATUS 6M |
Wavelength(s) | 0.918 |
Spacegroup name | P 1 |
Unit cell lengths | 56.140, 70.633, 77.624 |
Unit cell angles | 85.70, 89.75, 83.42 |
Refinement procedure
Resolution | 46.272 - 2.426 |
R-factor | 0.1853 |
Rwork | 0.182 |
R-free | 0.23980 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 1u7d |
RMSD bond length | 0.003 |
RMSD bond angle | 0.891 |
Data reduction software | XDS |
Data scaling software | XDS |
Phasing software | PHASER |
Refinement software | PHENIX ((1.10.1-2155_1168: ???)) |
Data quality characteristics
Overall | |
Low resolution limit [Å] | 46.272 |
High resolution limit [Å] | 2.426 |
Number of reflections | 153410 |
<I/σ(I)> | 22.88 |
Completeness [%] | 93.0 |
Redundancy | 3.67 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, SITTING DROP | 8 | 291 | Cacl2, PEG 400 |