8ZLV
Asymmetric Dimeric Structure of the Catalytic Domain in Truncated Threonine Deaminase
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 | 2023-05-01 |
Detector | DECTRIS PILATUS 6M |
Wavelength(s) | 0.9791 |
Spacegroup name | P 41 21 2 |
Unit cell lengths | 102.159, 102.159, 116.473 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 45.690 - 2.900 |
R-factor | 0.2165 |
Rwork | 0.214 |
R-free | 0.26860 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 1tdj |
RMSD bond length | 0.003 |
RMSD bond angle | 0.651 |
Data reduction software | XDS |
Data scaling software | Aimless |
Phasing software | MOLREP |
Refinement software | PHENIX (1.19.2-4158) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 46.780 | 3.004 |
High resolution limit [Å] | 2.900 | 2.900 |
Rmerge | 0.226 | 1.744 |
Rmeas | 0.232 | 1.787 |
Rpim | 0.051 | 0.386 |
Number of reflections | 14200 | 1409 |
<I/σ(I)> | 13.1 | 2.2 |
Completeness [%] | 99.8 | 100 |
Redundancy | 20.3 | 21.2 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 289.15 | 0.2 M CaCl2H4O2, 0.1 M HEPES sodium pH 7.5 and 28% v/v PEG 400 |