4JU5
Crystal structure of the dimeric form of the bb' domains of human protein disulfide isomerase
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | CHESS BEAMLINE F2 |
| Synchrotron site | CHESS |
| Beamline | F2 |
| Temperature [K] | 100 |
| Detector technology | CCD |
| Collection date | 2007-11-05 |
| Detector | ADSC QUANTUM 210 |
| Wavelength(s) | 1.7433 |
| Spacegroup name | P 1 |
| Unit cell lengths | 40.521, 45.718, 55.149 |
| Unit cell angles | 81.85, 92.15, 80.02 |
Refinement procedure
| Resolution | 44.550 - 2.280 |
| R-factor | 0.24533 |
| Rwork | 0.243 |
| R-free | 0.28982 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | PDB entries 3bj5 3ec3 |
| RMSD bond length | 0.006 |
| RMSD bond angle | 1.070 |
| Data reduction software | HKL-2000 |
| Data scaling software | HKL-2000 |
| Phasing software | PHASER |
| Refinement software | REFMAC (5.7.0029) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 500.000 | 2.380 |
| High resolution limit [Å] | 2.280 | 2.280 |
| Number of reflections | 15880 | |
| <I/σ(I)> | 23.5 | 5.4 |
| Completeness [%] | 92.8 | 92.7 |
| Redundancy | 7.5 | 7 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 4 | 295 | 25% (w/v) polyethylene glycol 1500, 25 mM sodium malonate, 37.5 mM imidazole, 37.5 mM boric acid, pH 4.0, VAPOR DIFFUSION, HANGING DROP, temperature 295K |
