9F38
BsmI (wild-type) crystallized with Ca2+ and cognate dsDNA
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | SOLEIL BEAMLINE PROXIMA 1 |
| Synchrotron site | SOLEIL |
| Beamline | PROXIMA 1 |
| Temperature [K] | 100 |
| Detector technology | PIXEL |
| Collection date | 2022-09-23 |
| Detector | DECTRIS EIGER X 9M |
| Wavelength(s) | 0.97856 |
| Spacegroup name | P 1 21 1 |
| Unit cell lengths | 65.735, 129.885, 100.733 |
| Unit cell angles | 90.00, 95.50, 90.00 |
Refinement procedure
| Resolution | 48.700 - 2.850 |
| R-factor | 0.2753 |
| Rwork | 0.274 |
| R-free | 0.29340 |
| Structure solution method | MOLECULAR REPLACEMENT |
| RMSD bond length | 0.005 |
| RMSD bond angle | 0.800 |
| Data reduction software | XDS |
| Data scaling software | STARANISO |
| Phasing software | MOLREP |
| Refinement software | BUSTER (2.10.4) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 48.700 | 2.920 |
| High resolution limit [Å] | 2.850 | 2.850 |
| Rmerge | 0.345 | 1.292 |
| Number of reflections | 24310 | 24310 |
| <I/σ(I)> | 4.5 | 1.7 |
| Completeness [%] | 99.8 | |
| Redundancy | 5.5 | |
| CC(1/2) | 0.957 | 0.531 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 291 | 100 mM MES, pH 6.5 100 mM CaCl2 25 % PEG 400 35 % Guanidine HCl |
