2J3R
The crystal structure of the bet3-trs31 heterodimer.
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | PHOTON FACTORY BEAMLINE AR-NW12A |
| Synchrotron site | Photon Factory |
| Beamline | AR-NW12A |
| Temperature [K] | 113 |
| Detector technology | CCD |
| Detector | ADSC CCD |
| Spacegroup name | C 1 2 1 |
| Unit cell lengths | 83.492, 93.348, 60.988 |
| Unit cell angles | 90.00, 92.41, 90.00 |
Refinement procedure
| Resolution | 30.000 - 2.600 |
| R-factor | 0.22 |
| Rwork | 0.220 |
| R-free | 0.25790 |
| Structure solution method | SAD |
| RMSD bond length | 0.007 |
| RMSD bond angle | 1.225 |
| Data scaling software | HKL-2000 |
| Phasing software | SOLVE |
| Refinement software | CNS |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 30.000 | |
| High resolution limit [Å] | 2.560 | 2.560 |
| Rmerge | 0.040 | 0.110 |
| Number of reflections | 14269 | |
| <I/σ(I)> | 53.2 | 10.5 |
| Completeness [%] | 93.2 | 78.5 |
| Redundancy | 5.7 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | 8 | 0.26 M AMMONIUM NITRATE AND 14% (W/V) POLYETHYLENE GLYCOL MONOMETHYL ETHER 5000, pH 8.00 |
