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 |