21JH
Faecalibacterium duncaniae branching enzyme FdBE2 unliganded form
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | PHOTON FACTORY BEAMLINE BL-5A |
| Synchrotron site | Photon Factory |
| Beamline | BL-5A |
| Temperature [K] | 100 |
| Detector technology | PIXEL |
| Collection date | 2022-12-14 |
| Detector | DECTRIS PILATUS3 6M |
| Wavelength(s) | 1.0 |
| Spacegroup name | C 1 2 1 |
| Unit cell lengths | 165.840, 73.988, 57.146 |
| Unit cell angles | 90.00, 91.29, 90.00 |
Refinement procedure
| Resolution | 47.540 - 1.700 |
| R-factor | 0.14984 |
| Rwork | 0.149 |
| R-free | 0.17284 |
| Structure solution method | MOLECULAR REPLACEMENT |
| RMSD bond length | 0.004 |
| RMSD bond angle | 1.197 |
| Data reduction software | XDS |
| Data scaling software | Aimless |
| Phasing software | MOLREP |
| Refinement software | REFMAC (5.8.0431) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 47.500 | 1.730 |
| High resolution limit [Å] | 1.700 | 1.700 |
| Rmerge | 0.031 | 0.310 |
| Rpim | 0.020 | 0.236 |
| Number of reflections | 75427 | 3887 |
| <I/σ(I)> | 16.3 | 2.2 |
| Completeness [%] | 99.2 | 96 |
| Redundancy | 3.3 | 2.4 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 8.5 | 293 | PEG4000, PEG3350, ammonium sulfate, Tris-HCl pH8.5 |
