6RHF
Structure of Chloroflexus aggregans Cagg_3753 LOV domain C85A variant (CagFbFP)
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | ESRF BEAMLINE ID23-1 |
Synchrotron site | ESRF |
Beamline | ID23-1 |
Temperature [K] | 100 |
Detector technology | PIXEL |
Collection date | 2017-10-23 |
Detector | DECTRIS PILATUS 6M-F |
Wavelength(s) | 0.9724 |
Spacegroup name | P 21 21 2 |
Unit cell lengths | 53.934, 110.044, 38.945 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 48.430 - 1.070 |
R-factor | 0.1259 |
Rwork | 0.125 |
R-free | 0.14840 |
Structure solution method | MOLECULAR REPLACEMENT |
RMSD bond length | 0.021 |
RMSD bond angle | 2.044 |
Data reduction software | XDS |
Data scaling software | Aimless (0.3.11) |
Phasing software | MOLREP |
Refinement software | REFMAC (5.8.0073) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 48.430 | 1.090 |
High resolution limit [Å] | 1.070 | 1.070 |
Rmerge | 0.066 | 2.060 |
Rmeas | 0.074 | 2.302 |
Rpim | 0.031 | 1.002 |
Total number of observations | 539872 | |
Number of reflections | 102522 | 4922 |
<I/σ(I)> | 9.6 | |
Completeness [%] | 99.6 | 97.8 |
Redundancy | 5.3 | 5 |
CC(1/2) | 0.998 | 0.293 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, SITTING DROP | 295 | 200 mM Ammonium citrate dibasic, 20% (w/v) PEG 3350 |