4OQ6
Crystal Structure of Human MCL-1 Bound to Inhibitor 4-hydroxy-4'-propylbiphenyl-3-carboxylic acid
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | APS BEAMLINE 17-ID |
| Synchrotron site | APS |
| Beamline | 17-ID |
| Temperature [K] | 100 |
| Detector technology | PIXEL |
| Detector | DECTRIS PILATUS 6M |
| Wavelength(s) | 1.0000 |
| Spacegroup name | C 1 2 1 |
| Unit cell lengths | 106.500, 61.830, 47.490 |
| Unit cell angles | 90.00, 116.42, 90.00 |
Refinement procedure
| Resolution | 51.880 - 1.810 |
| R-factor | 0.2031 |
| Rwork | 0.202 |
| R-free | 0.23020 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Phasing software | PHASER |
| Refinement software | BUSTER-TNT (2.5.1) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 51.880 | |
| High resolution limit [Å] | 1.810 | 1.810 |
| Number of reflections | 25174 | |
| Completeness [%] | 99.4 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, SITTING DROP | VAPOR DIFFUSION, SITTING DROP |
