9HYB
CRYSTAL STRUCTURE OF THE SMARCA2-VCB-COMPLEX WITH PROTAC P3
This is a non-PDB format compatible entry.
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | SLS BEAMLINE X10SA |
| Synchrotron site | SLS |
| Beamline | X10SA |
| Temperature [K] | 100 |
| Detector technology | PIXEL |
| Collection date | 2019-03-22 |
| Detector | DECTRIS PILATUS 6M-F |
| Wavelength(s) | 0.999880 |
| Spacegroup name | P 1 21 1 |
| Unit cell lengths | 108.378, 78.540, 171.575 |
| Unit cell angles | 90.00, 91.43, 90.00 |
Refinement procedure
| Resolution | 32.470 - 2.840 |
| R-factor | 0.252 |
| Rwork | 0.251 |
| R-free | 0.26500 |
| Structure solution method | MOLECULAR REPLACEMENT |
| RMSD bond length | 0.008 |
| RMSD bond angle | 0.920 |
| Data reduction software | XDS |
| Data scaling software | Aimless |
| Phasing software | BUSTER |
| Refinement software | BUSTER (2.11.7) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 108.340 | 3.225 |
| High resolution limit [Å] | 2.860 | 2.860 |
| Number of reflections | 42775 | 8971 |
| <I/σ(I)> | 8.6 | |
| Completeness [%] | 92.8 | |
| Redundancy | 4.4 | |
| CC(1/2) | 0.995 | 0.602 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, SITTING DROP | 7.5 | 293 | 0.1 M Bis-Tris propane, 20 % PEG 3350, 0.2 M tri-sodium citrate |
