6S95
Crystal structure of group I of Usutu virus envelope protein domain III
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | ESRF BEAMLINE ID29 |
Synchrotron site | ESRF |
Beamline | ID29 |
Temperature [K] | 100 |
Detector technology | PIXEL |
Collection date | 2017-07-25 |
Detector | DECTRIS PILATUS3 6M |
Wavelength(s) | 1.07227 |
Spacegroup name | P 21 21 21 |
Unit cell lengths | 47.544, 55.274, 65.774 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 38.530 - 1.190 |
Rwork | 0.199 |
R-free | 0.21650 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 1pjw |
Data reduction software | XDS |
Data scaling software | SCALA (3.3.22) |
Phasing software | PHASER (2.8.0) |
Refinement software | PHENIX (1.12-2829) |
Data quality characteristics
Overall | Inner shell | Outer shell | |
Low resolution limit [Å] | 42.316 | 47.544 | 1.250 |
High resolution limit [Å] | 1.190 | 3.760 | 1.190 |
Rmerge | 0.029 | 0.944 | |
Rmeas | 0.048 | 0.031 | 1.040 |
Rpim | 0.019 | 0.013 | 0.431 |
Total number of observations | 347611 | 11798 | 46359 |
Number of reflections | 56305 | 1964 | 8115 |
<I/σ(I)> | 18.1 | 60.2 | 1.6 |
Completeness [%] | 100.0 | 99.9 | 99.9 |
Redundancy | 6.2 | 6 | 5.7 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, SITTING DROP | 5.6 | 298 | NH4 Acet, Na3 Cit, PEG 4000 |