6SY8
Mopeia Virus Exonuclease domain fully depleted of Manganese un ALD compound
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | SOLEIL BEAMLINE PROXIMA 1 |
| Synchrotron site | SOLEIL |
| Beamline | PROXIMA 1 |
| Temperature [K] | 93.15 |
| Detector technology | PIXEL |
| Collection date | 2018-05-25 |
| Detector | DECTRIS PILATUS 6M |
| Wavelength(s) | 0.97857 |
| Spacegroup name | P 1 2 1 |
| Unit cell lengths | 45.853, 38.290, 137.315 |
| Unit cell angles | 90.00, 92.63, 90.00 |
Refinement procedure
| Resolution | 68.580 - 2.080 |
| R-factor | 0.25 |
| Rwork | 0.248 |
| R-free | 0.28300 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 6sx8 |
| RMSD bond length | 0.010 |
| RMSD bond angle | 1.030 |
| Data reduction software | XDS |
| Data scaling software | Aimless (0.7.2) |
| Phasing software | PHASER (2.8.2) |
| Refinement software | BUSTER (2.10.3) |
Data quality characteristics
| Overall | Inner shell | Outer shell | |
| Low resolution limit [Å] | 137.170 | 137.170 | 2.200 |
| High resolution limit [Å] | 2.080 | 6.590 | 2.080 |
| Rmerge | 0.121 | 0.053 | 0.993 |
| Rmeas | 0.135 | 0.059 | 1.096 |
| Rpim | 0.058 | 0.027 | 0.455 |
| Total number of observations | 151996 | 4327 | 22552 |
| Number of reflections | 28863 | 974 | 4153 |
| <I/σ(I)> | 10.6 | 25.3 | 2.4 |
| Completeness [%] | 99.6 | 99 | 99.4 |
| Redundancy | 5.3 | 4.4 | 5.4 |
| CC(1/2) | 0.996 | 0.996 | 0.942 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, SITTING DROP | 6.5 | 293.15 | 0.1 M MES 25 % (M/W) PEG 8000) 3mM Mn |
