2FWE
crystal structure of the C-terminal domain of the electron transfer catalyst DsbD (oxidized form)
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | SLS BEAMLINE X06SA |
Synchrotron site | SLS |
Beamline | X06SA |
Temperature [K] | 98.2 |
Detector technology | CCD |
Collection date | 2003-08-05 |
Detector | MARRESEARCH |
Wavelength(s) | 0.75141 |
Spacegroup name | P 21 21 21 |
Unit cell lengths | 30.265, 45.961, 73.768 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 20.000 - 1.650 |
Rwork | 0.165 |
R-free | 0.23500 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | modified version of 2TRX (see publication) |
RMSD bond length | 0.008 |
RMSD bond angle | 0.024 |
Data reduction software | DENZO |
Data scaling software | SCALEPACK |
Phasing software | AMoRE |
Refinement software | SHELXL-97 |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 20.000 | 1.710 |
High resolution limit [Å] | 1.650 | 1.650 |
Number of reflections | 13029 | |
<I/σ(I)> | 19 | 3.3 |
Completeness [%] | 99.5 | 97.7 |
Redundancy | 6.8 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, SITTING DROP | 4.6 | 277.15 | 0.3M sodium acetate, 0.1M sodium iodide, 40% PEG 4000, pH 4.6, VAPOR DIFFUSION, SITTING DROP, temperature 277.15K |