8XY1
Crystal structure of MPXV P1 protein
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | SSRF BEAMLINE BL02U1 |
| Synchrotron site | SSRF |
| Beamline | BL02U1 |
| Temperature [K] | 100 |
| Detector technology | PIXEL |
| Collection date | 2023-04-16 |
| Detector | DECTRIS PILATUS 6M |
| Wavelength(s) | 0.979152 |
| Spacegroup name | P 3 2 1 |
| Unit cell lengths | 114.417, 114.417, 126.789 |
| Unit cell angles | 90.00, 90.00, 120.00 |
Refinement procedure
| Resolution | 99.000 - 2.575 |
| Rwork | 0.196 |
| R-free | 0.24180 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 2i39 |
| RMSD bond length | 0.010 |
| RMSD bond angle | 1.597 |
| Data reduction software | XDS |
| Data scaling software | Aimless |
| Phasing software | MOLREP |
| Refinement software | REFMAC (5.8.0258) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 99.090 | 2.710 |
| High resolution limit [Å] | 2.570 | 2.570 |
| Number of reflections | 30914 | 4468 |
| <I/σ(I)> | 10.9 | |
| Completeness [%] | 100.0 | |
| Redundancy | 16 | |
| CC(1/2) | 0.998 | 0.740 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, SITTING DROP | 291 | 0.8 M Succinic acid, pH 7.0 |
