9BCG
Myeloid cell leukemia-1 (Mcl-1) complexed with compound
This is a non-PDB format compatible entry.
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | APS BEAMLINE 21-ID-G |
| Synchrotron site | APS |
| Beamline | 21-ID-G |
| Temperature [K] | 100 |
| Detector technology | IMAGE PLATE |
| Collection date | 2017-04-04 |
| Detector | MAR scanner 300 mm plate |
| Wavelength(s) | 0.9780 |
| Spacegroup name | P 21 21 2 |
| Unit cell lengths | 99.453, 136.858, 38.624 |
| Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
| Resolution | 38.654 - 1.898 |
| Rwork | 0.175 |
| R-free | 0.21030 |
| Structure solution method | MOLECULAR REPLACEMENT |
| RMSD bond length | 0.006 |
| RMSD bond angle | 1.475 |
| Data reduction software | HKL-2000 |
| Data scaling software | HKL-2000 |
| Phasing software | PHASER |
| Refinement software | REFMAC (5.8.0425) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 38.654 | 1.930 |
| High resolution limit [Å] | 1.898 | 1.900 |
| Rmerge | 0.142 | 0.613 |
| Rmeas | 0.156 | 0.699 |
| Rpim | 0.061 | 0.326 |
| Number of reflections | 41247 | 1991 |
| <I/σ(I)> | 10.4 | 1.4 |
| Completeness [%] | 96.4 | 96.7 |
| Redundancy | 5.8 | 4.1 |
| CC(1/2) | 0.165 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 292 | PEG 3350, Bis-Tris, Magnesium chloride |
