8J43
Reductive aminase RA29-WT
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SEALED TUBE |
| Source details | BRUKER D8 QUEST |
| Temperature [K] | 150 |
| Detector technology | PIXEL |
| Collection date | 2023-03-01 |
| Detector | Bruker PHOTON II |
| Wavelength(s) | 1.54178 |
| Spacegroup name | P 1 21 1 |
| Unit cell lengths | 42.521, 95.904, 67.395 |
| Unit cell angles | 90.00, 96.88, 90.00 |
Refinement procedure
| Resolution | 42.250 - 2.030 |
| R-factor | 0.2014 |
| Rwork | 0.199 |
| R-free | 0.23751 |
| Structure solution method | MOLECULAR REPLACEMENT |
| RMSD bond length | 0.009 |
| RMSD bond angle | 1.407 |
| Data reduction software | PROTEUM PLUS |
| Data scaling software | PROTEUM PLUS |
| Refinement software | PHENIX (1.19.2_4158) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 42.250 | 2.080 |
| High resolution limit [Å] | 2.030 | 2.030 |
| Rmerge | 0.114 | 0.453 |
| Number of reflections | 34365 | 2238 |
| <I/σ(I)> | 13.4 | |
| Completeness [%] | 99.1 | |
| Redundancy | 5.6 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, SITTING DROP | 7.5 | 289.2 | calcium acetate trihydrate,PEG3350 |
