9UG7
Structure of sulfonamide synthase SbzM from Actinokineospora mzabensis
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | PHOTON FACTORY BEAMLINE BL-1A |
| Synchrotron site | Photon Factory |
| Beamline | BL-1A |
| Temperature [K] | 100 |
| Detector technology | PIXEL |
| Collection date | 2024-06-14 |
| Detector | DECTRIS EIGER X 4M |
| Wavelength(s) | 1.018 |
| Spacegroup name | P 1 21 1 |
| Unit cell lengths | 75.617, 75.969, 105.032 |
| Unit cell angles | 90.00, 103.19, 90.00 |
Refinement procedure
| Resolution | 47.360 - 1.940 |
| R-factor | 0.204 |
| Rwork | 0.203 |
| R-free | 0.23850 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | AlphaFold |
| RMSD bond length | 0.007 |
| RMSD bond angle | 0.886 |
| Data reduction software | XDS |
| Data scaling software | Aimless |
| Phasing software | PHASER |
| Refinement software | PHENIX (1.21.1_5286) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 47.360 | 1.980 |
| High resolution limit [Å] | 1.940 | 1.940 |
| Rmerge | 0.106 | |
| Number of reflections | 85799 | 4487 |
| <I/σ(I)> | 9.4 | 4.1 |
| Completeness [%] | 99.8 | 99.8 |
| Redundancy | 3.9 | 4.1 |
| CC(1/2) | 0.990 | 0.588 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, SITTING DROP | 293 | 0.1 M MES buffer (pH=6.5), 10% PEG8000, 0.2 M MgCl2 |
