2W6R
Crystal structure of an artificial (ba)8-barrel protein designed from identical half barrels
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | SLS BEAMLINE X10SA |
| Synchrotron site | SLS |
| Beamline | X10SA |
| Temperature [K] | 100 |
| Detector technology | CCD |
| Detector | MARRESEARCH |
| Spacegroup name | P 31 2 1 |
| Unit cell lengths | 58.000, 58.000, 131.000 |
| Unit cell angles | 90.00, 90.00, 120.00 |
Refinement procedure
| Resolution | 32.950 - 2.100 |
| R-factor | 0.244 |
| Rwork | 0.242 |
| R-free | 0.28500 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 1thf |
| RMSD bond length | 0.013 |
| RMSD bond angle | 1.379 |
| Data reduction software | XDS |
| Phasing software | MOLREP |
| Refinement software | REFMAC (5.4.0066) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 40.000 | 2.150 |
| High resolution limit [Å] | 2.100 | 2.100 |
| Rmerge | 0.080 | 0.880 |
| Number of reflections | 15628 | |
| <I/σ(I)> | 14.8 | 2.4 |
| Completeness [%] | 99.3 | 96.6 |
| Redundancy | 8.5 | 7.6 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | 8 | 0.1 M TRIS-HCL PH 8.0, 12% W/V PEG 8000 |
