6G01
Complex of neuraminidase from H1N1 influenza virus with tamiphosphor monomethyl ester
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | BESSY BEAMLINE 14.1 |
Synchrotron site | BESSY |
Beamline | 14.1 |
Temperature [K] | 100 |
Detector technology | PIXEL |
Collection date | 2015-09-29 |
Detector | DECTRIS PILATUS 6M |
Wavelength(s) | 0.918409 |
Spacegroup name | C 2 2 21 |
Unit cell lengths | 118.583, 137.408, 118.451 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 44.890 - 1.610 |
R-factor | 0.17826 |
Rwork | 0.178 |
R-free | 0.20485 |
Structure solution method | MOLECULAR REPLACEMENT |
RMSD bond length | 0.014 |
RMSD bond angle | 1.636 |
Data reduction software | XDS |
Data scaling software | XDS |
Phasing software | MOLREP |
Refinement software | REFMAC (5.8.0189) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 44.890 | 1.710 |
High resolution limit [Å] | 1.610 | 1.610 |
Rmeas | 0.095 | 0.645 |
Number of reflections | 121339 | 19127 |
<I/σ(I)> | 10.29 | 1.88 |
Completeness [%] | 98.2 | 96.4 |
Redundancy | 3.13 | 2.79 |
CC(1/2) | 0.997 | 0.758 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 8 | 291 | 0.1 M HEPES, pH 7.75, 5% PEG 8000 |