3IDV
Crystal structure of the a0a fragment of ERp72
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | CHESS BEAMLINE A1 |
| Synchrotron site | CHESS |
| Beamline | A1 |
| Temperature [K] | 100 |
| Detector technology | CCD |
| Collection date | 2007-11-03 |
| Detector | ADSC QUANTUM 210 |
| Wavelength(s) | 0.9995 |
| Spacegroup name | P 41 21 2 |
| Unit cell lengths | 54.883, 54.883, 166.497 |
| Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
| Resolution | 45.830 - 1.950 |
| R-factor | 0.20841 |
| Rwork | 0.206 |
| R-free | 0.24577 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 2b5e |
| RMSD bond length | 0.014 |
| RMSD bond angle | 1.440 |
| Data reduction software | HKL-2000 |
| Data scaling software | HKL-2000 |
| Phasing software | PHASER |
| Refinement software | REFMAC (5.2.0005) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 50.000 | 2.020 |
| High resolution limit [Å] | 1.950 | 1.950 |
| Rmerge | 0.120 | 0.374 |
| Number of reflections | 18308 | |
| <I/σ(I)> | 14.8 | 6.9 |
| Completeness [%] | 99.9 | 99.9 |
| Redundancy | 8.5 | 7 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 8 | 293 | 0.01M zinc chloride, 20% PEG 6000, 0.1M Tris-HCl, pH 8.0, VAPOR DIFFUSION, HANGING DROP, temperature 293K |
