6BX5
The crystal structure of fluoride channel Fluc Ec2 with Monobody S12
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | ALS BEAMLINE 8.2.2 |
Synchrotron site | ALS |
Beamline | 8.2.2 |
Temperature [K] | 77 |
Detector technology | CCD |
Collection date | 2015-06-23 |
Detector | ADSC QUANTUM 315r |
Wavelength(s) | 0.999 |
Spacegroup name | P 41 21 2 |
Unit cell lengths | 105.441, 105.441, 183.015 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 91.530 - 3.000 |
R-factor | 0.2247 |
Rwork | 0.223 |
R-free | 0.24940 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 5kbn |
RMSD bond length | 0.019 |
RMSD bond angle | 2.069 |
Data reduction software | XDS |
Data scaling software | Aimless (0.5.32) |
Phasing software | PHASER (2.7.17) |
Refinement software | REFMAC (5.8.0189) |
Data quality characteristics
Overall | Inner shell | Outer shell | |
Low resolution limit [Å] | 91.530 | 91.510 | 3.180 |
High resolution limit [Å] | 3.000 | 9.000 | 3.000 |
Rmerge | 0.162 | 0.028 | 1.983 |
Rmeas | 0.165 | 0.029 | 2.018 |
Rpim | 0.031 | 0.006 | 0.372 |
Number of reflections | 21435 | 925 | 3380 |
<I/σ(I)> | 21.1 | ||
Completeness [%] | 100.0 | 99.6 | 100 |
Redundancy | 28.1 | 25 | 29.1 |
CC(1/2) | 1.000 | 1.000 | 0.842 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, SITTING DROP | 6.2 | 295 | 50 mM ADA-NaOH, 50 mM LiNO3, 34% PEG 400 |