9W3O
Crystal Structure of Human rhinovirus A2 3C Protease in Complex with a Broad-spectrum Inhibitor
This is a non-PDB format compatible entry.
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | SSRF BEAMLINE BL19U1 |
| Synchrotron site | SSRF |
| Beamline | BL19U1 |
| Temperature [K] | 100 |
| Detector technology | PIXEL |
| Collection date | 2025-04-18 |
| Detector | DECTRIS PILATUS3 6M |
| Wavelength(s) | 0.987 |
| Spacegroup name | C 1 2 1 |
| Unit cell lengths | 135.392, 42.023, 64.016 |
| Unit cell angles | 90.00, 92.30, 90.00 |
Refinement procedure
| Resolution | 47.430 - 1.760 |
| R-factor | 0.2383 |
| Rwork | 0.236 |
| R-free | 0.26850 |
| Structure solution method | MOLECULAR REPLACEMENT |
| RMSD bond length | 0.011 |
| RMSD bond angle | 1.238 |
| Data reduction software | autoPX (beta4) |
| Data scaling software | pointless (9.0.005) |
| Phasing software | PHASER (1.19.2_4158) |
| Refinement software | PHENIX (1.19.2_4158) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 50.000 | 1.800 |
| High resolution limit [Å] | 1.760 | 1.760 |
| Number of reflections | 35639 | 2612 |
| <I/σ(I)> | 16.92 | |
| Completeness [%] | 1.0 | |
| Redundancy | 6.56 | |
| CC(1/2) | 0.841 | 0.697 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 7.4 | 277 | 0.1 M HEPES pH 7.4 10% PEG 6000, 5%(w/v) MPD |
