3FK8
The crystal structure of disulphide isomerase from Xylella fastidiosa Temecula1
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | APS BEAMLINE 19-ID |
| Synchrotron site | APS |
| Beamline | 19-ID |
| Temperature [K] | 100 |
| Detector technology | CCD |
| Collection date | 2008-10-23 |
| Detector | ADSC QUANTUM 315 |
| Wavelength(s) | 0.97942 |
| Spacegroup name | P 21 21 21 |
| Unit cell lengths | 35.325, 50.236, 65.858 |
| Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
| Resolution | 27.540 - 1.300 |
| R-factor | 0.15543 |
| Rwork | 0.154 |
| R-free | 0.17916 |
| Structure solution method | SAD |
| RMSD bond length | 0.016 |
| RMSD bond angle | 1.591 |
| Data reduction software | HKL-3000 |
| Data scaling software | HKL-3000 |
| Phasing software | SHELXD |
| Refinement software | REFMAC (5.5.0054) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 27.540 | 1.320 |
| High resolution limit [Å] | 1.300 | 1.300 |
| Rmerge | 0.062 | 0.765 |
| Number of reflections | 29212 | |
| <I/σ(I)> | 32.6 | 1.76 |
| Completeness [%] | 99.5 | 100 |
| Redundancy | 4.6 | 4.3 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, SITTING DROP | 8.5 | 289 | 0.1M Tris, 0.2M Trimethylamine N-oxide, 20% PEG MME 2000, pH 8.5, VAPOR DIFFUSION, SITTING DROP, temperature 289K |
