3ZID
CetZ from Methanosaeta thermophila strain DSM 6194
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | ESRF BEAMLINE ID23-1 |
| Synchrotron site | ESRF |
| Beamline | ID23-1 |
| Temperature [K] | 100 |
| Detector technology | PIXEL |
| Collection date | 2012-12-06 |
| Detector | DECTRIS PILATUS 6M |
| Spacegroup name | P 1 21 1 |
| Unit cell lengths | 44.547, 107.011, 76.966 |
| Unit cell angles | 90.00, 91.42, 90.00 |
Refinement procedure
| Resolution | 28.762 - 2.000 |
| R-factor | 0.1845 |
| Rwork | 0.182 |
| R-free | 0.22900 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | LOWER RESOLUTION STRUCTURE OF CETZ |
| RMSD bond length | 0.008 |
| RMSD bond angle | 1.211 |
| Data reduction software | XDS |
| Data scaling software | SCALA |
| Phasing software | PHASER |
| Refinement software | PHENIX ((PHENIX.REFINE)) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 50.000 | 2.110 |
| High resolution limit [Å] | 2.000 | 2.000 |
| Rmerge | 0.040 | 0.660 |
| Number of reflections | 45108 | |
| <I/σ(I)> | 11.4 | 1.5 |
| Completeness [%] | 92.9 | 92.3 |
| Redundancy | 1.8 | 1.8 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | 7.5 | 30% (V/V) 1,2 PROPANEDIOL, 20% (V/V) PEG-400, 0.1 M HEPES PH 7.5 |
