8ZKV
Engineering Threonine Deaminase Catalytic Domain into a Tetrameric Configuration, Independent of Allosteric Regulation
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | SSRF BEAMLINE BL18U1 |
Synchrotron site | SSRF |
Beamline | BL18U1 |
Temperature [K] | 100 |
Detector technology | PIXEL |
Collection date | 2020-09-01 |
Detector | DECTRIS PILATUS 6M |
Wavelength(s) | 0.9791 |
Spacegroup name | C 1 2 1 |
Unit cell lengths | 147.567, 83.808, 143.245 |
Unit cell angles | 90.00, 112.51, 90.00 |
Refinement procedure
Resolution | 44.110 - 2.560 |
Rwork | 0.191 |
R-free | 0.23290 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 1tdj |
RMSD bond length | 0.006 |
RMSD bond angle | 0.713 |
Data reduction software | XDS |
Data scaling software | Aimless |
Phasing software | MOLREP |
Refinement software | PHENIX ((1.20.1_4487: ???)) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 44.300 | 2.640 |
High resolution limit [Å] | 2.560 | 2.560 |
Rmerge | 0.132 | 0.847 |
Rmeas | 0.157 | 1.000 |
Rpim | 0.084 | 0.537 |
Number of reflections | 52203 | 4428 |
<I/σ(I)> | 9.5 | |
Completeness [%] | 99.8 | 98.6 |
Redundancy | 6.7 | |
CC(1/2) | 0.996 | 0.725 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 289.15 | 1.5 M (NH4)2SO4 and 0.1 M Tris pH 8.5 |