5G5D
Crystal Structure of the CohScaC2-XDocCipA type II complex from Clostridium thermocellum
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | ESRF BEAMLINE ID29 |
| Synchrotron site | ESRF |
| Beamline | ID29 |
| Temperature [K] | 100 |
| Detector technology | PIXEL |
| Collection date | 2013-06-21 |
| Detector | PILATUS |
| Spacegroup name | I 2 2 2 |
| Unit cell lengths | 52.360, 125.805, 130.467 |
| Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
| Resolution | 90.560 - 3.000 |
| R-factor | 0.26065 |
| Rwork | 0.256 |
| R-free | 0.30308 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 2bm3 |
| RMSD bond length | 0.007 |
| RMSD bond angle | 1.221 |
| Data reduction software | XDS |
| Data scaling software | SCALA |
| Phasing software | PHASER |
| Refinement software | REFMAC (5.8.0135) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 90.570 | 3.180 |
| High resolution limit [Å] | 2.890 | 3.000 |
| Rmerge | 0.190 | 1.180 |
| Number of reflections | 10000 | |
| <I/σ(I)> | 5.9 | 1.5 |
| Completeness [%] | 99.1 | 99 |
| Redundancy | 1.9 | 7.2 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | 0.2M CACL2 0.1M HEPES 7.5 25% PEG4K |
