5VVL
Cas1-Cas2 bound to full-site mimic with Ni
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | SSRL BEAMLINE BL9-2 |
| Synchrotron site | SSRL |
| Beamline | BL9-2 |
| Temperature [K] | 80 |
| Detector technology | PIXEL |
| Collection date | 2017-03-04 |
| Detector | DECTRIS PILATUS3 6M |
| Wavelength(s) | 0.9795 |
| Spacegroup name | P 1 21 1 |
| Unit cell lengths | 74.642, 197.728, 88.792 |
| Unit cell angles | 90.00, 111.35, 90.00 |
Refinement procedure
| Resolution | 39.504 - 3.310 |
| R-factor | 0.2262 |
| Rwork | 0.224 |
| R-free | 0.26290 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 5ds5 |
| RMSD bond length | 0.003 |
| RMSD bond angle | 0.493 |
| Data reduction software | XDS |
| Data scaling software | Aimless (0.5.31) |
| Phasing software | PHASER |
| Refinement software | PHENIX (1.11.1_2575) |
Data quality characteristics
| Overall | Inner shell | Outer shell | |
| Low resolution limit [Å] | 39.550 | 39.550 | 3.070 |
| High resolution limit [Å] | 2.960 | 11.480 | 2.960 |
| Rmerge | 0.203 | 0.037 | 4.410 |
| Rmeas | 0.220 | 0.040 | 4.792 |
| Rpim | 0.083 | 0.016 | 1.842 |
| Total number of observations | 329343 | ||
| Number of reflections | 47810 | ||
| <I/σ(I)> | 7.9 | ||
| Completeness [%] | 96.3 | 95.7 | 71.8 |
| Redundancy | 6.9 | 6.5 | 6.3 |
| CC(1/2) | 0.996 | 0.999 | 0.215 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 6.4 | 281 | 100 mM MES pH 6.4, 20% (w/v) PEG MME 2000, 0.2 M NaCl, 3 mM NiCl2 |
