8JIB
Crystal Structure of Prophenoloxidase PPO6 from Aedes aegypti
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | NSLS BEAMLINE X17B1 |
| Synchrotron site | NSLS |
| Beamline | X17B1 |
| Temperature [K] | 100 |
| Detector technology | PIXEL |
| Collection date | 2022-11-19 |
| Detector | DECTRIS EIGER X 9M |
| Wavelength(s) | 0.920 |
| Spacegroup name | P 1 21 1 |
| Unit cell lengths | 121.041, 364.149, 125.522 |
| Unit cell angles | 90.00, 118.95, 90.00 |
Refinement procedure
| Resolution | 48.660 - 3.150 |
| R-factor | 0.27134 |
| Rwork | 0.269 |
| R-free | 0.31041 |
| Structure solution method | MOLECULAR REPLACEMENT |
| RMSD bond length | 0.005 |
| RMSD bond angle | 1.286 |
| Data reduction software | XDS |
| Data scaling software | Aimless |
| Phasing software | MR-Rosetta |
| Refinement software | REFMAC (5.8.0419) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 48.660 | 3.320 |
| High resolution limit [Å] | 3.150 | 3.150 |
| Rmerge | 0.241 | 0.910 |
| Rmeas | 0.278 | |
| Rpim | 0.135 | 0.499 |
| Number of reflections | 161746 | 23632 |
| <I/σ(I)> | 5 | 1.5 |
| Completeness [%] | 98.8 | 98.8 |
| Redundancy | 3.8 | 3.7 |
| CC(1/2) | 0.967 | 0.429 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 6.5 | 291.15 | 0.2 M MgCl2,0.1 M Sodium Cacodylate pH6.5,10%-15% v/v PEG 1000 |
