6G6N
Crystal structure of the computationally designed Tako8 protein in C2
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | DIAMOND BEAMLINE I04 |
Synchrotron site | Diamond |
Beamline | I04 |
Temperature [K] | 100 |
Detector technology | PIXEL |
Collection date | 2017-10-26 |
Detector | DECTRIS PILATUS3 6M |
Wavelength(s) | 0.9795 |
Spacegroup name | C 1 2 1 |
Unit cell lengths | 93.548, 132.297, 81.015 |
Unit cell angles | 90.00, 125.26, 90.00 |
Refinement procedure
Resolution | 46.774 - 2.001 |
R-factor | 0.2459 |
Rwork | 0.243 |
R-free | 0.26630 |
Structure solution method | MOLECULAR REPLACEMENT |
RMSD bond length | 0.003 |
RMSD bond angle | 0.620 |
Data reduction software | XDS |
Data scaling software | Aimless |
Phasing software | PHASER |
Refinement software | PHENIX ((1.13_2998: ???)) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 46.774 | 2.050 |
High resolution limit [Å] | 2.000 | 2.000 |
Rpim | 0.025 | 0.304 |
Number of reflections | 54194 | |
<I/σ(I)> | 18.5 | 3.6 |
Completeness [%] | 99.9 | 100 |
Redundancy | 6.8 | 7 |
CC(1/2) | 0.999 | 0.862 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION | 293.15 | 0.1M citrate pH5.0, 3.4M NaCl |