8X7H
Crystal structure of the ternary complex of GID4-PROTAC(NEP162)-BRD4(BD1).
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | SSRF BEAMLINE BL19U1 |
| Synchrotron site | SSRF |
| Beamline | BL19U1 |
| Temperature [K] | 80 |
| Detector technology | PIXEL |
| Collection date | 2023-07-10 |
| Detector | DECTRIS PILATUS 6M |
| Wavelength(s) | 0.978530 |
| Spacegroup name | P 1 |
| Unit cell lengths | 56.855, 87.613, 88.440 |
| Unit cell angles | 103.09, 90.90, 106.23 |
Refinement procedure
| Resolution | 38.460 - 2.900 |
| R-factor | 0.2388 |
| Rwork | 0.235 |
| R-free | 0.30100 |
| Structure solution method | MOLECULAR REPLACEMENT |
| RMSD bond length | 0.014 |
| RMSD bond angle | 1.759 |
| Data reduction software | XDS |
| Data scaling software | XDS |
| Phasing software | PHENIX |
| Refinement software | PHENIX ((1.20.1_4487: ???)) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 47.810 | 3.010 |
| High resolution limit [Å] | 2.900 | 2.900 |
| Rmerge | 0.090 | 0.528 |
| Number of reflections | 34488 | 3438 |
| <I/σ(I)> | 9.97 | |
| Completeness [%] | 97.1 | |
| Redundancy | 3.5 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, SITTING DROP | 291 | 0.2M potassium sodium tartrate tetrahydrate, 0.1M Bis-Tris pH 6.5, 10% (w/v) polyethylene glycol 10000 |






