8VQ2
HSV1 polymerase ternary complex with dsDNA and compound 44
This is a non-PDB format compatible entry.
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | APS BEAMLINE 17-ID |
| Synchrotron site | APS |
| Beamline | 17-ID |
| Temperature [K] | 100 |
| Detector technology | PIXEL |
| Collection date | 2018-03-07 |
| Detector | DECTRIS EIGER2 X 9M |
| Wavelength(s) | 0.91936 |
| Spacegroup name | P 41 |
| Unit cell lengths | 180.628, 180.628, 231.875 |
| Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
| Resolution | 43.809 - 3.829 |
| R-factor | 0.2099 |
| Rwork | 0.209 |
| R-free | 0.22690 |
| Structure solution method | MOLECULAR REPLACEMENT |
| RMSD bond length | 0.004 |
| RMSD bond angle | 0.660 |
| Data reduction software | autoPROC |
| Data scaling software | autoPROC |
| Phasing software | PHENIX |
| Refinement software | PHENIX ((1.10.1_2155: ???)) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 231.875 | 3.895 |
| High resolution limit [Å] | 3.829 | 3.829 |
| Rmerge | 0.209 | 1.337 |
| Rpim | 0.082 | 0.524 |
| Number of reflections | 70570 | 3109 |
| <I/σ(I)> | 11.1 | 2.4 |
| Completeness [%] | 98.8 | 88 |
| Redundancy | 13.8 | |
| CC(1/2) | 0.997 | 0.717 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 283 | 0.1 M sodium cacodylate pH 6.7, 0.6 M succinic acid pH 7.0 |
