7ABY
Crystal structure of iLOV-Q489K mutant
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 | 2017-11-27 |
Detector | DECTRIS PILATUS 6M-F |
Wavelength(s) | 0.9194 |
Spacegroup name | P 43 21 2 |
Unit cell lengths | 40.756, 40.756, 131.791 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 38.937 - 1.450 |
R-factor | 0.1576 |
Rwork | 0.156 |
R-free | 0.18470 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 4ees |
Data reduction software | XDS (VERSION Jun 1, 2017 BUILT=20170601) |
Data scaling software | Aimless (0.5.32) |
Phasing software | MOLREP (Vers 11.5.05; 04.08.2017) |
Refinement software | PHENIX (1.13_2998) |
Data quality characteristics
Overall | Inner shell | Outer shell | |
Low resolution limit [Å] | 43.930 | 43.930 | 1.480 |
High resolution limit [Å] | 1.450 | 7.810 | 1.450 |
Rmerge | 0.070 | 0.032 | 1.107 |
Rmeas | 0.074 | 0.035 | 1.170 |
Rpim | 0.025 | 0.013 | 0.376 |
Total number of observations | 186700 | 1295 | 9847 |
Number of reflections | 20710 | 190 | 1030 |
<I/σ(I)> | 14.3 | 38.1 | 2.1 |
Completeness [%] | 100.0 | 99.7 | 100 |
Redundancy | 9 | 6.8 | 9.6 |
CC(1/2) | 0.999 | 0.999 | 0.775 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, SITTING DROP | 4.6 | 292.15 | 0.1 M sodium acetate, 25 % (w/v) PEG 1000 |