8A7H
Crystal structure of a chimeric LOV-Histidine kinase SB2F1-I66R mutant (light state; asymmetrical variant, trigonal form with long c axis)
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 | 2016-07-21 |
Detector | DECTRIS PILATUS 6M-F |
Wavelength(s) | 0.97625 |
Spacegroup name | P 31 2 1 |
Unit cell lengths | 139.420, 139.420, 89.881 |
Unit cell angles | 90.00, 90.00, 120.00 |
Refinement procedure
Resolution | 45.640 - 3.145 |
R-factor | 0.2574 |
Rwork | 0.253 |
R-free | 0.30560 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | D_1292121855 |
RMSD bond length | 0.005 |
RMSD bond angle | 0.861 |
Data reduction software | XDS |
Data scaling software | Aimless |
Phasing software | MOLREP |
Refinement software | PHENIX (1.19rc6_4061) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 45.640 | 3.336 |
High resolution limit [Å] | 3.145 | 3.145 |
Rmerge | 0.163 | |
Rmeas | 0.168 | |
Rpim | 0.038 | 0.610 |
Number of reflections | 12416 | 621 |
<I/σ(I)> | 12.5 | 1.5 |
Completeness [%] | 69.6 | 21.6 |
Redundancy | 19.7 | |
CC(1/2) | 0.996 | 0.483 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, SITTING DROP | 9.3 | 292.15 | 18% PEG3300, 0.1M Bicine, 0.2M LiSO4, 1mM ATP, 2mM MgCl2 |