6NSB
Crystal structure of the IVR-165 (H3N2) influenza virus hemagglutinin in complex with 6'-SLNLN
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | APS BEAMLINE 23-ID-B |
Synchrotron site | APS |
Beamline | 23-ID-B |
Temperature [K] | 100 |
Detector technology | PIXEL |
Collection date | 2017-04-23 |
Detector | DECTRIS EIGER X 16M |
Wavelength(s) | 1.0332 |
Spacegroup name | H 3 2 |
Unit cell lengths | 101.123, 101.123, 387.229 |
Unit cell angles | 90.00, 90.00, 120.00 |
Refinement procedure
Resolution | 50.000 - 1.750 |
R-factor | 0.16594 |
Rwork | 0.165 |
R-free | 0.18686 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 4o5n |
RMSD bond length | 0.011 |
RMSD bond angle | 1.529 |
Data scaling software | HKL-2000 (712) |
Phasing software | PHASER (2.5.6) |
Refinement software | REFMAC (5.8.0158) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 50.000 | 1.810 |
High resolution limit [Å] | 1.750 | 1.750 |
Rpim | 0.020 | 0.230 |
Number of reflections | 76888 | 6920 |
<I/σ(I)> | 39 | 1.8 |
Completeness [%] | 100.0 | 100 |
Redundancy | 37.7 | |
CC(1/2) | 1.000 | 0.920 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, SITTING DROP | 277 | 44% 2-methyl-2,4-pentanediol, 0.1 M HEPES pH 7.0 |