2B6M
Structure of the DsbA mutant (P31A-C33A)
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | ESRF BEAMLINE BM30A |
| Synchrotron site | ESRF |
| Beamline | BM30A |
| Temperature [K] | 100 |
| Detector technology | CCD |
| Collection date | 2005-04-30 |
| Detector | MARRESEARCH |
| Wavelength(s) | 0.97951 |
| Spacegroup name | P 32 |
| Unit cell lengths | 56.047, 56.047, 114.038 |
| Unit cell angles | 90.00, 90.00, 120.00 |
Refinement procedure
| Resolution | 25.000 - 2.650 |
| Rwork | 0.240 |
| R-free | 0.25840 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | reduced wild type DsbA |
| RMSD bond length | 0.009 |
| RMSD bond angle | 1.274 |
| Data reduction software | MOSFLM |
| Data scaling software | SCALA |
| Phasing software | MOLREP |
| Refinement software | CNS (1.1) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 2.790 | |
| High resolution limit [Å] | 2.650 | 2.650 |
| Rmerge | 0.074 | 0.549 |
| Number of reflections | 11635 | |
| <I/σ(I)> | 8.5 | 1.5 |
| Completeness [%] | 99.9 | 100 |
| Redundancy | 5.6 | 5.4 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, SITTING DROP | 8.2 | 293 | PEG 3350, ammonium phosphate, pH 8.2, VAPOR DIFFUSION, SITTING DROP, temperature 293K |
