3Q5S
Crystal structure of BmrR bound to Acetylcholine
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | SSRL BEAMLINE BL9-2 |
Synchrotron site | SSRL |
Beamline | BL9-2 |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2010-07-08 |
Detector | MARMOSAIC 325 mm CCD |
Spacegroup name | P 43 2 2 |
Unit cell lengths | 106.407, 106.407, 145.571 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 45.230 - 3.100 |
R-factor | 0.227 |
Rwork | 0.225 |
R-free | 0.27600 |
Structure solution method | MOLECULAR REPLACEMENT |
RMSD bond length | 0.012 |
RMSD bond angle | 1.479 |
Data reduction software | DENZO |
Data scaling software | SCALEPACK |
Phasing software | REFMAC |
Refinement software | REFMAC |
Data quality characteristics
Overall | |
Low resolution limit [Å] | 45.230 |
High resolution limit [Å] | 3.100 |
Completeness [%] | 17.2 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | 7 | 291 | 1.0 M Sodium Malonate ph 7.0 0.05% Jeffamine M600, VAPOR DIFFUSION, HANGING DROP, temperature 291K |