2IYI
structure of a light-induced intermediate of the BLUF domain of the rhodobacterial protein AppA
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | SLS BEAMLINE X10SA |
| Synchrotron site | SLS |
| Beamline | X10SA |
| Temperature [K] | 100 |
| Detector technology | CCD |
| Detector | MARRESEARCH |
| Spacegroup name | P 65 2 2 |
| Unit cell lengths | 126.400, 126.400, 64.900 |
| Unit cell angles | 90.00, 90.00, 120.00 |
Refinement procedure
| Resolution | 19.860 - 2.950 |
| R-factor | 0.19 |
| Rwork | 0.188 |
| R-free | 0.22800 |
| Structure solution method | SAD |
| RMSD bond length | 0.012 |
| RMSD bond angle | 1.422 |
| Data reduction software | XDS |
| Data scaling software | XSCALE |
| Refinement software | REFMAC (5.2.0005) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 20.000 | 3.030 |
| High resolution limit [Å] | 2.800 | 2.950 |
| Rmerge | 0.070 | 0.250 |
| Number of reflections | 6700 | |
| <I/σ(I)> | 20 | 6 |
| Completeness [%] | 100.0 | 99.8 |
| Redundancy | 7 | 7.3 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | 8.5 | pH 8.50 |
