9Y16
WT human DNA polymerase beta, Binary complex templating dG
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SEALED TUBE |
| Source details | BRUKER IMUS MICROFOCUS |
| Temperature [K] | 100 |
| Detector technology | PIXEL |
| Collection date | 2024-12-03 |
| Detector | Bruker PHOTON II |
| Wavelength(s) | 1.54 |
| Spacegroup name | P 1 21 1 |
| Unit cell lengths | 54.088, 78.488, 54.699 |
| Unit cell angles | 90.00, 104.88, 90.00 |
Refinement procedure
| Resolution | 23.450 - 1.800 |
| R-factor | 0.1736 |
| Rwork | 0.170 |
| R-free | 0.20910 |
| Structure solution method | MOLECULAR REPLACEMENT |
| RMSD bond length | 0.007 |
| RMSD bond angle | 0.864 |
| Data reduction software | PROTEUM PLUS (3) |
| Data scaling software | PROTEUM PLUS (3) |
| Phasing software | PHENIX |
| Refinement software | PHENIX (1.20.1_4487) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 25.000 | 1.860 |
| High resolution limit [Å] | 1.800 | 1.800 |
| Rmerge | 0.056 | 0.422 |
| Rmeas | 0.059 | 0.460 |
| Rpim | 0.019 | 0.182 |
| Number of reflections | 80425 | 4049 |
| <I/σ(I)> | 22.6 | 4.7 |
| Completeness [%] | 99.9 | 99.4 |
| Redundancy | 8.4 | 6.25 |
| CC(1/2) | 0.999 | 0.916 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 7.5 | 291 | 13-16% PEG 3350, 150-300 mM sodium acetate, 50 mM HEPES, 1 mM TECP 250uM protein with 300 uM DNA assembly mixed 1:1 with reagent |
