7ETK
The complex structure of FtmOx1 bond with fumitremorgen B at 1.22 angstrom
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | SSRF BEAMLINE BL19U1 |
| Synchrotron site | SSRF |
| Beamline | BL19U1 |
| Temperature [K] | 100 |
| Detector technology | PIXEL |
| Collection date | 2019-05-30 |
| Detector | DECTRIS PILATUS3 6M |
| Wavelength(s) | 0.97854 |
| Spacegroup name | P 1 21 1 |
| Unit cell lengths | 62.024, 77.782, 62.208 |
| Unit cell angles | 90.00, 103.71, 90.00 |
Refinement procedure
| Resolution | 30.218 - 1.220 |
| R-factor | 0.15155900346 |
| Rwork | 0.150 |
| R-free | 0.17205 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 4ZON |
| RMSD bond length | 0.007 |
| RMSD bond angle | 1.084 |
| Data reduction software | HKL-3000 |
| Data scaling software | HKL-3000 |
| Phasing software | PHASER |
| Refinement software | PHENIX (1.11.1_2575) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 50.000 | 1.240 |
| High resolution limit [Å] | 1.220 | 1.220 |
| Rmerge | 0.061 | |
| Number of reflections | 168451 | 7861 |
| <I/σ(I)> | 26.95 | |
| Completeness [%] | 99.1 | |
| Redundancy | 6.5 | |
| CC(1/2) | 0.998 | 0.833 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, SITTING DROP | 293 | 0.1 M Bis-tris pH 7.0, 1.8 M Ammonium sulfate and 0.1 M sodium malonate pH 7.0 |
