4PA7
Structure of NavMS pore and C-terminal domain crystallised in presence of channel blocking compound
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | DIAMOND BEAMLINE I03 |
Synchrotron site | Diamond |
Beamline | I03 |
Temperature [K] | 100 |
Detector technology | PIXEL |
Collection date | 2003-10-21 |
Detector | DECTRIS PILATUS 6M-F |
Wavelength(s) | 0.91966 |
Spacegroup name | C 2 2 21 |
Unit cell lengths | 79.810, 328.860, 79.920 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 45.200 - 3.020 |
R-factor | 0.2519 |
Rwork | 0.251 |
R-free | 0.26450 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | using 3ZJZ as a starting molecule |
RMSD bond length | 0.010 |
RMSD bond angle | 1.100 |
Refinement software | BUSTER (2.10.0) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 45.200 | 3.210 |
High resolution limit [Å] | 3.020 | 3.020 |
Rmerge | 0.167 | 0.578 |
Number of reflections | 21117 | |
<I/σ(I)> | 9.7 | 3.4 |
Completeness [%] | 99.8 | 99 |
Redundancy | 8.7 | 8.7 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, SITTING DROP | 8 | 277 | 0.1 M sodium citrate, 0.1 M TRIS, pH 8.0, 34 % PEG |