3E8V
Crystal structure of a possible transglutaminase-family protein proteolytic fragment from Bacteroides fragilis
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | APS BEAMLINE 31-ID |
Synchrotron site | APS |
Beamline | 31-ID |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2008-07-18 |
Detector | MAR CCD 165 mm |
Wavelength(s) | 0.97958 |
Spacegroup name | P 31 2 1 |
Unit cell lengths | 82.006, 82.006, 32.367 |
Unit cell angles | 90.00, 90.00, 120.00 |
Refinement procedure
Resolution | 15.000 - 2.400 |
R-factor | 0.226 |
Rwork | 0.225 |
R-free | 0.24300 |
Structure solution method | SAD |
RMSD bond length | 0.014 |
RMSD bond angle | 1.527 |
Data reduction software | MOSFLM |
Data scaling software | SCALA (3.2.19) |
Phasing software | SHELXCD |
Refinement software | REFMAC |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 19.699 | 2.530 |
High resolution limit [Å] | 2.400 | 2.400 |
Rmerge | 0.100 | 0.574 |
Total number of observations | 16470 | |
Number of reflections | 5079 | |
<I/σ(I)> | 30.1 | 5.8 |
Completeness [%] | 99.9 | 99.8 |
Redundancy | 22 | 22.3 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION | 6.5 | 294 | 100mM sodium cacodylate pH 6.5, 1.4M sodium acetate hydrate, Vapor diffusion, temperature 294K |