5U7A
Crystal structure of a complex formed between MerB and Dimethyltin
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | NSLS BEAMLINE X25 |
Synchrotron site | NSLS |
Beamline | X25 |
Temperature [K] | 100 |
Detector technology | PIXEL |
Collection date | 2011-11-20 |
Detector | DECTRIS PILATUS 6M |
Wavelength(s) | 1.10 |
Spacegroup name | P 1 21 1 |
Unit cell lengths | 38.055, 88.648, 51.490 |
Unit cell angles | 90.00, 100.34, 90.00 |
Refinement procedure
Resolution | 43.980 - 1.532 |
R-factor | 0.1748 |
Rwork | 0.173 |
R-free | 0.21050 |
RMSD bond length | 0.011 |
RMSD bond angle | 1.346 |
Data reduction software | HKL-2000 |
Data scaling software | HKL-2000 |
Phasing software | PHASER |
Refinement software | PHENIX (1.9_1692) |
Data quality characteristics
Overall | |
Low resolution limit [Å] | 50.000 |
High resolution limit [Å] | 1.530 |
Number of reflections | 43607 |
<I/σ(I)> | 16.45 |
Completeness [%] | 86.5 |
Redundancy | 3 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 5.5 | 296 | 23 % polyethylene glycol 2000 MME, 0.2 M sodium acetate pH 5.5, 0.2 M potassium bromide. Before flash freezing, the same precipitant was used except 25% polyethylene glycol 2000 MME was used as a cryo-protectant. |