8X5P
Crystal structure of MjHKUr-CoV spike HR1 in complex with EK1 peptide
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | ROTATING ANODE |
| Source details | RIGAKU |
| Temperature [K] | 100 |
| Detector technology | CCD |
| Collection date | 2023-10-18 |
| Detector | RIGAKU |
| Wavelength(s) | 1.5418 |
| Spacegroup name | C 1 2 1 |
| Unit cell lengths | 73.373, 42.344, 169.294 |
| Unit cell angles | 90.00, 98.22, 90.00 |
Refinement procedure
| Resolution | 29.610 - 2.510 |
| R-factor | 0.2318 |
| Rwork | 0.229 |
| R-free | 0.28430 |
| Structure solution method | MOLECULAR REPLACEMENT |
| RMSD bond length | 0.006 |
| RMSD bond angle | 0.764 |
| Data reduction software | XDS |
| Data scaling software | Aimless |
| Phasing software | PHASER |
| Refinement software | PHENIX ((1.20.1_4487: ???)) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 29.610 | 2.610 |
| High resolution limit [Å] | 2.510 | 2.510 |
| Number of reflections | 17070 | 1922 |
| <I/σ(I)> | 14.6 | |
| Completeness [%] | 94.5 | |
| Redundancy | 4 | |
| CC(1/2) | 0.997 | 0.965 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 289 | 0.1M Sodium Citrate, Citric Acid pH 5.5, 20%(w/v) PEG 3000 |
