4FFZ
Crystal Structure of DENV1-E111 fab fragment bound to DENV-1 DIII (Western Pacific-74 strain).
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | APS BEAMLINE 19-ID |
| Synchrotron site | APS |
| Beamline | 19-ID |
| Temperature [K] | 100 |
| Detector technology | CCD |
| Collection date | 2011-08-19 |
| Detector | ADSC QUANTUM 315 |
| Wavelength(s) | 1.007 |
| Spacegroup name | P 1 21 1 |
| Unit cell lengths | 82.865, 52.013, 136.402 |
| Unit cell angles | 90.00, 107.49, 90.00 |
Refinement procedure
| Resolution | 43.448 - 3.800 |
| R-factor | 0.2375 |
| Rwork | 0.237 |
| R-free | 0.27760 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 4aeh 4ffy |
| RMSD bond length | 0.003 |
| RMSD bond angle | 0.859 |
| Data reduction software | DENZO |
| Data scaling software | SCALEPACK |
| Phasing software | PHASER (1.7.3) |
| Refinement software | PHENIX (1.7.3_928) |
Data quality characteristics
| Overall | Inner shell | Outer shell | |
| Low resolution limit [Å] | 50.000 | 50.000 | 3.970 |
| High resolution limit [Å] | 3.800 | 7.590 | 3.800 |
| Rmerge | 0.120 | 0.056 | 0.514 |
| Number of reflections | 11029 | ||
| <I/σ(I)> | 9.74 | 1.91 | |
| Completeness [%] | 98.0 | 95.5 | 98.6 |
| Redundancy | 4.1 | 3.8 | 4 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 6 | 293 | 20% PEG 6000, 0.1M MES, 1% glycerol., pH 6.0, VAPOR DIFFUSION, HANGING DROP, temperature 293K |
