5NQX
Structure of a fHbp(V1.1):PorA(P1.16) chimera. Fusion at fHbp position 294.
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | DIAMOND BEAMLINE I02 |
Synchrotron site | Diamond |
Beamline | I02 |
Temperature [K] | 100 |
Detector technology | PIXEL |
Collection date | 2013-12-12 |
Detector | DECTRIS PILATUS 6M-F |
Wavelength(s) | 0.97858 |
Spacegroup name | P 2 21 21 |
Unit cell lengths | 94.850, 114.900, 160.340 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 81.636 - 3.660 |
R-factor | 0.2348 |
Rwork | 0.232 |
R-free | 0.28150 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 4ayd |
RMSD bond length | 0.002 |
RMSD bond angle | 0.424 |
Data reduction software | xia2 |
Data scaling software | xia2 |
Phasing software | PHASER |
Refinement software | PHENIX ((1.10_2155: ???)) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 81.650 | 3.760 |
High resolution limit [Å] | 3.660 | 3.660 |
Rmerge | 0.187 | 0.833 |
Rpim | 0.101 | 0.439 |
Number of reflections | 19820 | 1431 |
<I/σ(I)> | 7.6 | 1.9 |
Completeness [%] | 99.3 | 99.9 |
Redundancy | 4.4 | 4.6 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, SITTING DROP | 294 | 20% (w/v) PEG4000, 0.3M ammonium sulphate |