7QYP
The structure of T. forsythia NanH
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | DIAMOND BEAMLINE I04 |
| Synchrotron site | Diamond |
| Beamline | I04 |
| Temperature [K] | 100 |
| Detector technology | PIXEL |
| Collection date | 2017-12-04 |
| Detector | DECTRIS PILATUS3 6M |
| Wavelength(s) | 0.97951 |
| Spacegroup name | P 41 21 2 |
| Unit cell lengths | 79.895, 79.895, 349.328 |
| Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
| Resolution | 78.005 - 1.659 |
| Rwork | 0.222 |
| R-free | 0.27270 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 4bbw |
| RMSD bond length | 0.012 |
| RMSD bond angle | 1.681 |
| Data reduction software | xia2 |
| Data scaling software | Aimless |
| Phasing software | PHASER |
| Refinement software | REFMAC (5.8.0267) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 79.890 | 1.690 |
| High resolution limit [Å] | 1.659 | 1.660 |
| Rmerge | 0.168 | 0.851 |
| Number of reflections | 135097 | 6572 |
| <I/σ(I)> | 6.9 | 0.9 |
| Completeness [%] | 100.0 | 99.21 |
| Redundancy | 12.1 | |
| CC(1/2) | 0.992 | 0.435 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 6 | 290 | 7% PEG6000 0.1M HEPES |
