7A6P
Structural determinants underlying the adduct lifetime in a short LOV protein PpSB2-LOV
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | ESRF BEAMLINE ID23-2 |
Synchrotron site | ESRF |
Beamline | ID23-2 |
Temperature [K] | 100 |
Detector technology | PIXEL |
Collection date | 2015-03-08 |
Detector | DECTRIS PILATUS3 X 2M |
Wavelength(s) | 0.8726 |
Spacegroup name | P 1 21 1 |
Unit cell lengths | 37.142, 88.467, 54.180 |
Unit cell angles | 90.00, 106.03, 90.00 |
Refinement procedure
Resolution | 44.880 - 1.930 |
R-factor | 0.1777 |
Rwork | 0.177 |
R-free | 0.19440 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 3sw1 |
RMSD bond length | 0.008 |
RMSD bond angle | 0.905 |
Data reduction software | XDS |
Data scaling software | Aimless (0.5.27) |
Phasing software | MOLREP |
Refinement software | PHENIX (1.10.1_2155) |
Data quality characteristics
Overall | Inner shell | Outer shell | |
Low resolution limit [Å] | 44.880 | 44.880 | 1.980 |
High resolution limit [Å] | 1.930 | 9.050 | 1.930 |
Rmerge | 0.097 | 0.039 | 0.890 |
Rmeas | 0.111 | 0.045 | |
Rpim | 0.053 | 0.022 | 0.508 |
Total number of observations | 107111 | ||
Number of reflections | 25353 | 259 | 1705 |
<I/σ(I)> | 8.9 | ||
Completeness [%] | 100.0 | 99.6 | 100 |
Redundancy | 4.2 | 4.2 | 4 |
CC(1/2) | 0.997 | 0.997 | 0.450 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, SITTING DROP | 5.3 | 292.15 | Sodium acetate, polyethylene glycol 200, polyethylene glycol 3350 |