2XVA
Crystal structure of the tellurite detoxification protein TehB from E. coli in complex with sinefungin
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | DIAMOND BEAMLINE I03 |
| Synchrotron site | Diamond |
| Beamline | I03 |
| Temperature [K] | 100 |
| Detector technology | CCD |
| Collection date | 2010-07-19 |
| Detector | ADSC QUANTUM 315 |
| Spacegroup name | P 1 21 1 |
| Unit cell lengths | 59.100, 55.590, 129.700 |
| Unit cell angles | 90.00, 95.93, 90.00 |
Refinement procedure
| Resolution | 40.000 - 1.900 |
| R-factor | 0.17766 |
| Rwork | 0.175 |
| R-free | 0.23423 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 2i6g |
| RMSD bond length | 0.015 |
| RMSD bond angle | 1.515 |
| Data reduction software | XDS |
| Data scaling software | SCALA |
| Phasing software | PHASER |
| Refinement software | REFMAC (5.5.0106) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 42.100 | 2.000 |
| High resolution limit [Å] | 1.900 | 1.900 |
| Rmerge | 0.080 | 0.410 |
| Number of reflections | 62310 | |
| <I/σ(I)> | 7.4 | 1.9 |
| Completeness [%] | 94.6 | 97.2 |
| Redundancy | 1.9 | 1.9 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | 8 | 0.2M NAF, 22% PEG 3350, 5MM SINEFUNGIN, pH 8 |
