7AK3
CLK1 bound with CAF052
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | DIAMOND BEAMLINE I04 |
| Synchrotron site | Diamond |
| Beamline | I04 |
| Temperature [K] | 100 |
| Detector technology | PIXEL |
| Collection date | 2018-07-14 |
| Detector | DECTRIS PILATUS 6M-F |
| Wavelength(s) | 0.979500 |
| Spacegroup name | C 1 2 1 |
| Unit cell lengths | 91.022, 64.159, 78.529 |
| Unit cell angles | 90.00, 119.31, 90.00 |
Refinement procedure
| Resolution | 45.310 - 2.500 |
| R-factor | 0.2134 |
| Rwork | 0.211 |
| R-free | 0.25990 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 1z57 |
| RMSD bond length | 0.004 |
| RMSD bond angle | 1.283 |
| Data reduction software | XDS |
| Data scaling software | Aimless (0.7.4) |
| Phasing software | PHASER |
| Refinement software | REFMAC (5.8.0258) |
Data quality characteristics
| Overall | Inner shell | Outer shell | |
| Low resolution limit [Å] | 47.960 | 47.960 | 2.600 |
| High resolution limit [Å] | 2.500 | 9.010 | 2.500 |
| Rmerge | 0.061 | 0.037 | 0.468 |
| Rmeas | 0.078 | 0.047 | 0.603 |
| Rpim | 0.048 | 0.029 | 0.374 |
| Total number of observations | 31003 | 649 | 3534 |
| Number of reflections | 13502 | 295 | 1527 |
| <I/σ(I)> | 7.5 | 18.5 | 1.8 |
| Completeness [%] | 98.0 | 94.1 | 98.1 |
| Redundancy | 2.3 | 2.2 | 2.3 |
| CC(1/2) | 0.995 | 0.994 | 0.880 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, SITTING DROP | 9.3 | 278 | 23% PEG 6000, 0.1 M bicine |
