7OMU
Thermosipho africanus DarTG in complex with ADP-ribose
This is a non-PDB format compatible entry.
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | DIAMOND BEAMLINE I03 |
| Synchrotron site | Diamond |
| Beamline | I03 |
| Temperature [K] | 100 |
| Detector technology | PIXEL |
| Collection date | 2016-09-10 |
| Detector | DECTRIS PILATUS 6M-F |
| Wavelength(s) | 0.9763 |
| Spacegroup name | I 2 3 |
| Unit cell lengths | 187.458, 187.458, 187.458 |
| Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
| Resolution | 76.647 - 2.960 |
| Rwork | 0.211 |
| R-free | 0.24820 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 5m31 |
| RMSD bond length | 0.004 |
| RMSD bond angle | 1.244 |
| Data reduction software | DIALS |
| Data scaling software | Aimless |
| Phasing software | PHASER |
| Refinement software | REFMAC (5.8.0267) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 93.730 | 3.040 |
| High resolution limit [Å] | 2.960 | 2.960 |
| Rmerge | 0.074 | 1.713 |
| Rmeas | 0.078 | 1.799 |
| Rpim | 0.024 | 0.545 |
| Number of reflections | 22975 | 1690 |
| <I/σ(I)> | 17.3 | 1.5 |
| Completeness [%] | 100.0 | |
| Redundancy | 10.7 | |
| CC(1/2) | 1.000 | 0.533 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, SITTING DROP | 294 | 0.2 M potassium thiocyanate, 0.1 M TRIS pH 7.5, 8% (w/v) PEG 20,000, 8% (v/v) PEG500MME |
