7WQ9
Crystal structure of SARS-CoV-2 main protease in complex with Z-IETD-FMK
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | NSRRC BEAMLINE BL15A1 |
Synchrotron site | NSRRC |
Beamline | BL15A1 |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2020-07-25 |
Detector | RAYONIX MX300HE |
Wavelength(s) | 1.00000 |
Spacegroup name | C 1 2 1 |
Unit cell lengths | 110.387, 55.248, 46.901 |
Unit cell angles | 90.00, 101.52, 90.00 |
Refinement procedure
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 30.000 | 2.130 |
High resolution limit [Å] | 2.054 | 2.054 |
Rmerge | 0.059 | 0.494 |
Number of reflections | 17239 | 1714 |
<I/σ(I)> | 20.47 | 2.3 |
Completeness [%] | 99.5 | 98.7 |
Redundancy | 3.6 | 3.3 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, SITTING DROP | 293 | 0.1 M MES monohydrate pH 6.0, 20% w/v Polyethylene glycol monomethyl ether 2,000 |