7Y9O
Crystal structure of a CYP109B4 variant from Bacillus sonorensis
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | LIQUID ANODE |
| Source details | BRUKER METALJET |
| Temperature [K] | 100 |
| Detector technology | PIXEL |
| Collection date | 2021-12-15 |
| Detector | Bruker PHOTON III |
| Wavelength(s) | 1.34138 |
| Spacegroup name | P 21 21 21 |
| Unit cell lengths | 47.870, 62.602, 140.526 |
| Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
| Resolution | 38.060 - 1.840 |
| R-factor | 0.1921 |
| Rwork | 0.191 |
| R-free | 0.22220 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 4rm4 |
| RMSD bond length | 0.011 |
| RMSD bond angle | 1.620 |
| Data reduction software | SAINT |
| Data scaling software | SAINT |
| Phasing software | PHASER |
| Refinement software | REFMAC (5.8.0267) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 38.060 | 1.870 |
| High resolution limit [Å] | 1.840 | 1.840 |
| Rmerge | 0.077 | 0.327 |
| Number of reflections | 37491 | 1732 |
| <I/σ(I)> | 15.9 | |
| Completeness [%] | 99.8 | 100 |
| Redundancy | 8.04 | 3.69 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, SITTING DROP | 7 | 298 | 0.2M calcium acetate hydrate, 0.1M Tris (pH 7.0), 18% Polyethylene glycol 3000 |
