5ECU
The unliganded structure of Caldicellulosiruptor saccharolyticus GH5
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | SSRL BEAMLINE BL11-1 |
| Synchrotron site | SSRL |
| Beamline | BL11-1 |
| Temperature [K] | 100 |
| Detector technology | PIXEL |
| Collection date | 2012-04-12 |
| Detector | DECTRIS PILATUS 6M |
| Wavelength(s) | 0.97945 |
| Spacegroup name | I 2 3 |
| Unit cell lengths | 146.660, 146.660, 146.660 |
| Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
| Resolution | 19.960 - 1.500 |
| R-factor | 0.08651 |
| Rwork | 0.085 |
| R-free | 0.11477 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 1g01 |
| RMSD bond length | 0.028 |
| RMSD bond angle | 2.681 |
| Data reduction software | XDS |
| Data scaling software | XSCALE |
| Phasing software | MOLREP |
| Refinement software | REFMAC (5.8.0131) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 20.000 | 1.540 |
| High resolution limit [Å] | 1.500 | 1.500 |
| Rmerge | 0.095 | 0.887 |
| Number of reflections | 83455 | |
| <I/σ(I)> | 42.5 | 6 |
| Completeness [%] | 100.0 | 100 |
| Redundancy | 59 | 40 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, SITTING DROP | 7 | 293 | 1.0 M sodium malonate pH 7.0 |
