6S6C
Ground state structure of Archaerhodopsin-3 at 100K
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | DIAMOND BEAMLINE I24 |
Synchrotron site | Diamond |
Beamline | I24 |
Temperature [K] | 100 |
Detector technology | PIXEL |
Collection date | 2018-10-19 |
Detector | DECTRIS PILATUS3 6M |
Wavelength(s) | 0.96862 |
Spacegroup name | P 21 21 21 |
Unit cell lengths | 44.669, 47.357, 104.193 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 52.100 - 1.070 |
R-factor | 0.1587 |
Rwork | 0.158 |
R-free | 0.17040 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 1uaz |
RMSD bond length | 0.004 |
RMSD bond angle | 1.205 |
Data reduction software | DIALS (1.10.1) |
Data scaling software | Aimless |
Phasing software | PHASER (2.7.17) |
Refinement software | REFMAC (5.8.0232) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 52.100 | 1.090 |
High resolution limit [Å] | 1.070 | 1.070 |
Rmeas | 0.208 | 0.179 |
Rpim | 0.044 | 1.717 |
Number of reflections | 98595 | 4610 |
<I/σ(I)> | 9.2 | 0.4 |
Completeness [%] | 99.8 | 94.8 |
Redundancy | 22.8 | 15.1 |
CC(1/2) | 0.999 | 0.179 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | LIPIDIC CUBIC PHASE | 5.5 | 293 | 100mM MES pH 5.5, 33% PEG 600, 150mM Na chloride, 150mM Ca chloride |