5MUO
X-ray structure of the 2-22' locally-closed mutant of GLIC in complex with propofol
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | ESRF BEAMLINE MASSIF-3 |
Synchrotron site | ESRF |
Beamline | MASSIF-3 |
Temperature [K] | 80 |
Detector technology | PIXEL |
Collection date | 2016-03-03 |
Detector | DECTRIS EIGER X 4M |
Wavelength(s) | 0.96 |
Spacegroup name | C 1 2 1 |
Unit cell lengths | 180.980, 132.900, 159.920 |
Unit cell angles | 90.00, 101.84, 90.00 |
Refinement procedure
Resolution | 20.000 - 3.190 |
R-factor | 0.19 |
Rwork | 0.189 |
R-free | 0.20420 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 3tlv |
RMSD bond length | 0.010 |
RMSD bond angle | 1.120 |
Data reduction software | XDS |
Data scaling software | SCALA |
Phasing software | REFMAC |
Refinement software | BUSTER (2.10.2) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 49.230 | 3.050 |
High resolution limit [Å] | 2.900 | 2.900 |
Rmerge | 0.071 | 0.677 |
Number of reflections | 78570 | |
<I/σ(I)> | 13 | 2 |
Completeness [%] | 99.4 | 96.5 |
Redundancy | 3.8 | 3.8 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 4 | 293 | PH 4, VAPOR DIFFUSION, TEMPERATURE 293K |