7XQ3
Crystal structure of the tetramer of thioredoxin domain containing-protein of Oncomelania hupensis(OhTRP14)
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 | 2020-01-06 |
Detector | PSI PILATUS 6M |
Wavelength(s) | 0.97930 |
Spacegroup name | P 1 21 1 |
Unit cell lengths | 59.665, 46.017, 94.115 |
Unit cell angles | 90.00, 108.32, 90.00 |
Refinement procedure
Resolution | 35.740 - 1.770 |
R-factor | 0.2629 |
Rwork | 0.258 |
R-free | 0.30510 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 1wou |
RMSD bond length | 0.012 |
RMSD bond angle | 1.801 |
Data reduction software | HKL-3000 |
Data scaling software | HKL-2000 |
Phasing software | PHASER |
Refinement software | REFMAC (5.8.0258) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 50.000 | 1.800 |
High resolution limit [Å] | 1.770 | 1.770 |
Rmerge | 0.109 | 0.273 |
Number of reflections | 47643 | 47643 |
<I/σ(I)> | 15.528 | |
Completeness [%] | 100.0 | |
Redundancy | 6.6 | |
CC(1/2) | 0.967 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, SITTING DROP | 4 | 289 | 30% PEG 3350, 0.2M Sodium malonate pH 4.0 |