3AUL
Crystal structure of wild-type Lys48-linked diubiquitin in an open conformation
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | SPRING-8 BEAMLINE BL44XU |
| Synchrotron site | SPring-8 |
| Beamline | BL44XU |
| Temperature [K] | 100 |
| Detector technology | CCD |
| Collection date | 2008-07-07 |
| Detector | Bruker DIP-6040 |
| Wavelength(s) | 0.9 |
| Spacegroup name | P 1 21 1 |
| Unit cell lengths | 23.820, 56.690, 46.610 |
| Unit cell angles | 90.00, 93.33, 90.00 |
Refinement procedure
| Resolution | 20.000 - 2.390 |
| R-factor | 0.20525 |
| Rwork | 0.203 |
| R-free | 0.25166 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 1tbe |
| RMSD bond length | 0.012 |
| RMSD bond angle | 1.192 |
| Data reduction software | MOSFLM |
| Data scaling software | SCALA |
| Phasing software | MOLREP |
| Refinement software | REFMAC (5.5.0109) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 50.000 | 2.510 |
| High resolution limit [Å] | 2.380 | 2.380 |
| Rmerge | 0.149 | 0.276 |
| Number of reflections | 4854 | |
| <I/σ(I)> | 6.2 | 4.3 |
| Completeness [%] | 96.5 | 84.2 |
| Redundancy | 3.1 | 3 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 6 | 293 | 20% PEG 3350, 0.2M litium sulfate, pH 6.0, VAPOR DIFFUSION, HANGING DROP, temperature 293.0K |
