7XIL
SARS-CoV-2-Beta-RBD and B38-GWP/P-VK antibody complex
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 | 2022-01-20 |
| Detector | DECTRIS PILATUS 6M |
| Wavelength(s) | 0.97852 |
| Spacegroup name | C 1 2 1 |
| Unit cell lengths | 194.723, 84.102, 56.857 |
| Unit cell angles | 90.00, 100.19, 90.00 |
Refinement procedure
| Resolution | 27.740 - 2.910 |
| R-factor | 0.2113 |
| Rwork | 0.206 |
| R-free | 0.25620 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 7bz5 |
| RMSD bond length | 0.004 |
| RMSD bond angle | 0.780 |
| Data reduction software | HKL-2000 |
| Data scaling software | HKL-2000 |
| Phasing software | PHASER |
| Refinement software | PHENIX (1.20.1-4487) |
Data quality characteristics
| Overall | Inner shell | Outer shell | |
| Low resolution limit [Å] | 50.000 | 50.000 | 2.930 |
| High resolution limit [Å] | 2.880 | 7.810 | 2.880 |
| Rmerge | 0.193 | 0.110 | 0.687 |
| Rmeas | 0.211 | 0.120 | 0.760 |
| Rpim | 0.083 | 0.048 | 0.318 |
| Total number of observations | 122259 | ||
| Number of reflections | 19665 | 1028 | 987 |
| <I/σ(I)> | 2.4 | ||
| Completeness [%] | 99.4 | 99.2 | 99.9 |
| Redundancy | 6.2 | 6.1 | 5.5 |
| CC(1/2) | 0.972 | 0.719 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, SITTING DROP | 291 | 0.2M Imidazole malate, 15% W/V PEG 4000 |
