8BGR
FAD-independent Methylene-Tetrahydrofolate Reductase from Mycobacterium hassiacum
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | SLS BEAMLINE X10SA |
Synchrotron site | SLS |
Beamline | X10SA |
Temperature [K] | 100 |
Detector technology | PIXEL |
Collection date | 2022-07-04 |
Detector | DECTRIS EIGER2 X 16M |
Wavelength(s) | 1.0 |
Spacegroup name | P 43 21 2 |
Unit cell lengths | 45.790, 45.790, 257.410 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 37.310 - 1.800 |
R-factor | 0.2331 |
Rwork | 0.232 |
R-free | 0.24940 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | Alphafold Model |
RMSD bond length | 0.003 |
RMSD bond angle | 0.597 |
Data reduction software | XDS |
Data scaling software | XSCALE |
Phasing software | PHASER |
Refinement software | PHENIX (1.20.1_4487) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 50.000 | 1.900 |
High resolution limit [Å] | 1.800 | 1.800 |
Rmeas | 0.104 | 1.300 |
Number of reflections | 26845 | 3422 |
<I/σ(I)> | 9 | 2 |
Completeness [%] | 94.9 | |
Redundancy | 4.3 | |
CC(1/2) | 0.996 | 0.851 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, SITTING DROP | 281 | 15% PEG 6000 |