2H0H
Crystal Structure of DsbG K113E mutant
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | APS BEAMLINE 22-BM |
Synchrotron site | APS |
Beamline | 22-BM |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2005-11-28 |
Detector | MARMOSAIC 225 mm CCD |
Wavelength(s) | 0.9724 |
Spacegroup name | C 1 2 1 |
Unit cell lengths | 117.110, 56.980, 85.003 |
Unit cell angles | 90.00, 94.84, 90.00 |
Refinement procedure
Resolution | 20.000 - 1.800 |
Rwork | 0.197 |
R-free | 0.22900 |
Structure solution method | FOURIER SYNTHESIS |
Starting model (for MR) | 1v57 |
RMSD bond length | 0.005 |
RMSD bond angle | 1.200 |
Data reduction software | MX (SYSTEM) |
Data scaling software | HKL-2000 |
Phasing software | CNS |
Refinement software | CNS (1.1) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 20.000 | 1.860 |
High resolution limit [Å] | 1.800 | 1.800 |
Rmerge | 0.063 | 0.320 |
Number of reflections | 52294 | |
<I/σ(I)> | 20 | 3 |
Completeness [%] | 99.6 | 97.4 |
Redundancy | 4.1 | 3.9 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 3.9 | 277 | 17% PEG 4000, 0.1M sodium citrate, 0.2M ammonium sulfate, pH 3.9, VAPOR DIFFUSION, HANGING DROP, temperature 277K |