3GFR
Structure of YhdA, D137L variant
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | EMBL/DESY, HAMBURG BEAMLINE X13 |
Synchrotron site | EMBL/DESY, HAMBURG |
Beamline | X13 |
Temperature [K] | 100 |
Detector technology | IMAGE PLATE |
Collection date | 2005-07-12 |
Detector | MAR scanner 345 mm plate |
Wavelength(s) | 0.8148 |
Spacegroup name | P 1 |
Unit cell lengths | 51.491, 56.080, 64.176 |
Unit cell angles | 84.06, 77.02, 74.49 |
Refinement procedure
Resolution | 19.971 - 2.403 |
R-factor | 0.202 |
Rwork | 0.199 |
R-free | 0.25100 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 1nni |
RMSD bond length | 0.002 |
RMSD bond angle | 0.614 |
Data reduction software | DENZO |
Data scaling software | SCALEPACK |
Phasing software | PHASER |
Refinement software | PHENIX |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 20.000 | 2.440 |
High resolution limit [Å] | 2.400 | 2.400 |
Number of reflections | 24878 | |
<I/σ(I)> | 3.2 | |
Completeness [%] | 95.0 | 88.8 |
Redundancy | 2 | 1.9 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | batch crystallization | 6.5 | 298 | 0.1 M Bis-Tris pH 6.5, 20% w/v PEG MME 5000, batch crystallization, temperature 298K |