3LY8
Crystal structure of mutant D471E of the periplasmic domain of CadC
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | BESSY BEAMLINE 14.2 |
Synchrotron site | BESSY |
Beamline | 14.2 |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2009-09-30 |
Detector | RAYONIX MX-225 |
Wavelength(s) | 0.91841 |
Spacegroup name | P 61 2 2 |
Unit cell lengths | 83.630, 83.630, 199.491 |
Unit cell angles | 90.00, 90.00, 120.00 |
Refinement procedure
Resolution | 72.430 - 1.900 |
R-factor | 0.203 |
Rwork | 0.202 |
R-free | 0.23100 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 3ly7 |
RMSD bond length | 0.014 |
RMSD bond angle | 1.300 |
Data reduction software | MOSFLM |
Data scaling software | SCALA (3.3.9) |
Phasing software | PHASER |
Refinement software | REFMAC |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 72.430 | 2.000 |
High resolution limit [Å] | 1.897 | 1.900 |
Rmerge | 0.276 | |
Number of reflections | 33613 | |
<I/σ(I)> | 8.8 | |
Completeness [%] | 99.9 | 100 |
Redundancy | 13.5 | 13.7 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 7.5 | 293 | 1.7 M ammonium sulfate, 5% (v/v) 2-propanol, pH 7.5, VAPOR DIFFUSION, HANGING DROP, temperature 293K |