6YX4
Structure of Chloroflexus aggregans flavin based fluorescent protein (CagFbFP) Q148K variant with morpholine
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | ESRF BEAMLINE ID29 |
| Synchrotron site | ESRF |
| Beamline | ID29 |
| Temperature [K] | 100 |
| Detector technology | PIXEL |
| Collection date | 2018-02-09 |
| Detector | DECTRIS PILATUS 6M-F |
| Wavelength(s) | 0.9737 |
| Spacegroup name | P 21 21 2 |
| Unit cell lengths | 57.663, 110.557, 39.015 |
| Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
| Resolution | 39.940 - 1.360 |
| R-factor | 0.1416 |
| Rwork | 0.140 |
| R-free | 0.17210 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 6rhf |
| RMSD bond length | 0.007 |
| RMSD bond angle | 1.429 |
| Data reduction software | XDS |
| Data scaling software | Aimless (0.7.4) |
| Phasing software | MOLREP |
| Refinement software | REFMAC (5.8.0238) |
Data quality characteristics
| Overall | Inner shell | Outer shell | |
| Low resolution limit [Å] | 39.940 | 39.900 | 1.380 |
| High resolution limit [Å] | 1.360 | 7.450 | 1.360 |
| Rmerge | 0.050 | 0.031 | 0.767 |
| Rmeas | 0.055 | 0.034 | 0.843 |
| Rpim | 0.023 | 0.014 | 0.344 |
| Total number of observations | 2128 | 14567 | |
| Number of reflections | 53232 | 405 | 2525 |
| <I/σ(I)> | 15.3 | 47 | 2 |
| Completeness [%] | 97.6 | 99 | 94.4 |
| Redundancy | 5.9 | 5.3 | 5.8 |
| CC(1/2) | 0.999 | 0.999 | 0.799 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, SITTING DROP | 295 | 0.1M MES pH 6.5, 12% PEG 20000 |
