7QCR
MLLT4/Afadin PDZ domain in complex with the C-terminal peptide from protein E of SARS-CoV-2
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | SOLEIL BEAMLINE PROXIMA 1 |
| Synchrotron site | SOLEIL |
| Beamline | PROXIMA 1 |
| Temperature [K] | 100 |
| Detector technology | PIXEL |
| Collection date | 2021-02-07 |
| Detector | PSI PILATUS 6M |
| Wavelength(s) | 0.97857 |
| Spacegroup name | C 1 2 1 |
| Unit cell lengths | 76.160, 43.490, 56.070 |
| Unit cell angles | 90.00, 96.88, 90.00 |
Refinement procedure
| Resolution | 37.810 - 2.280 |
| R-factor | 0.2223 |
| Rwork | 0.221 |
| R-free | 0.25230 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 3axa |
| RMSD bond length | 0.008 |
| RMSD bond angle | 1.080 |
| Data reduction software | XDS |
| Data scaling software | XDS |
| Phasing software | PHASER |
| Refinement software | BUSTER (2.10.3) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 37.810 | 2.362 |
| High resolution limit [Å] | 2.280 | 2.281 |
| Rmerge | 0.218 | 1.454 |
| Number of reflections | 8373 | 746 |
| <I/σ(I)> | 6.59 | |
| Completeness [%] | 98.9 | |
| Redundancy | 6.8 | |
| CC(1/2) | 0.988 | 0.506 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 277.15 | 1 M Na3 Citrate, 0.1 M TRIS at pH 7, 0.2 M NaCl |
