9I0F
Revisited AvNifEN crystal structure
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | SSRL BEAMLINE BL12-2 |
| Synchrotron site | SSRL |
| Beamline | BL12-2 |
| Temperature [K] | 100 |
| Detector technology | CCD |
| Collection date | 2008-04-25 |
| Detector | MARMOSAIC 325 mm CCD |
| Wavelength(s) | 1.033 |
| Spacegroup name | P 1 21 1 |
| Unit cell lengths | 146.070, 95.220, 149.980 |
| Unit cell angles | 90.00, 95.50, 90.00 |
Refinement procedure
| Resolution | 39.830 - 2.400 |
| R-factor | 0.2542 |
| Rwork | 0.249 |
| R-free | 0.30450 |
| Structure solution method | MOLECULAR REPLACEMENT |
| RMSD bond length | 0.007 |
| RMSD bond angle | 0.860 |
| Data reduction software | XDS |
| Data scaling software | SCALA |
| Phasing software | MOLREP |
| Refinement software | BUSTER (2.10.4 (10-JUL-2024)) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 39.830 | 2.430 |
| High resolution limit [Å] | 2.400 | 2.400 |
| Rmerge | 0.070 | 0.389 |
| Number of reflections | 139612 | 691 |
| <I/σ(I)> | 7.7 | |
| Completeness [%] | 87.2 | |
| Redundancy | 3.4 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | LIQUID DIFFUSION | 7.5 | 297 | 20% PEG 3350, 0.2M Magnersium Nitrate, pH 7.5, LIQUID DIFFUSION, temperature 297K |
