9CPF
Structural basis of BAK sequestration by MCL-1 and consequences for apoptosis initiation
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | APS BEAMLINE 22-ID |
| Synchrotron site | APS |
| Beamline | 22-ID |
| Temperature [K] | 124 |
| Detector technology | PIXEL |
| Collection date | 2020-02-06 |
| Detector | DECTRIS EIGER X 16M |
| Wavelength(s) | 1.0 |
| Spacegroup name | P 1 21 1 |
| Unit cell lengths | 88.757, 110.517, 126.019 |
| Unit cell angles | 90.00, 101.17, 90.00 |
Refinement procedure
| Resolution | 46.350 - 1.700 |
| R-factor | 0.1856 |
| Rwork | 0.185 |
| R-free | 0.22400 |
| Structure solution method | MOLECULAR REPLACEMENT |
| RMSD bond length | 0.012 |
| RMSD bond angle | 1.180 |
| Data reduction software | XDS |
| Data scaling software | HKL-2000 |
| Phasing software | MOLREP |
| Refinement software | PHENIX ((1.21_5207: ???)) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 46.350 | 1.730 |
| High resolution limit [Å] | 1.700 | 1.700 |
| Rmerge | 0.599 | |
| Number of reflections | 504731 | 19449 |
| <I/σ(I)> | 13.24 | |
| Completeness [%] | 97.6 | |
| Redundancy | 3.3 | |
| CC(1/2) | 0.999 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 295 | 15-25% PEG 4000, 0.2 M lithium sulfate, 0.1 M TRIS pH 8.5 |
