7EPS
Partial Consensus L-threonine 3-dehydrogenase (E-change)
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 | 2020-03-05 |
Detector | DECTRIS PILATUS3 6M |
Wavelength(s) | 1.0 |
Spacegroup name | C 1 2 1 |
Unit cell lengths | 86.108, 180.932, 141.713 |
Unit cell angles | 90.00, 90.01, 90.00 |
Refinement procedure
Resolution | 49.400 - 2.102 |
Rwork | 0.207 |
R-free | 0.23480 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 3wmx |
RMSD bond length | 0.011 |
RMSD bond angle | 1.607 |
Data reduction software | XDS |
Data scaling software | SCALA |
Phasing software | MOLREP |
Refinement software | REFMAC (5.8.0267) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 49.400 | 2.220 |
High resolution limit [Å] | 2.100 | 2.100 |
Rmerge | 0.087 | 0.570 |
Number of reflections | 878278 | 18253 |
<I/σ(I)> | 15.5 | |
Completeness [%] | 100.0 | |
Redundancy | 7 | |
CC(1/2) | 1.000 | 0.895 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, SITTING DROP | 295 | 20% [w/v] PEG 3350, 0.2M magnesium acetate |