3R5G
Crystal structure of the adenylyl cyclase CyaB from P. aeruginosa
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | SLS BEAMLINE X10SA |
Synchrotron site | SLS |
Beamline | X10SA |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2008-10-01 |
Detector | MARRESEARCH |
Wavelength(s) | 0.9791 |
Spacegroup name | P 1 2 1 |
Unit cell lengths | 51.360, 36.310, 94.760 |
Unit cell angles | 90.00, 98.76, 90.00 |
Refinement procedure
Resolution | 47.780 - 1.500 |
R-factor | 0.18803 |
Rwork | 0.186 |
R-free | 0.23019 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 1wc1 |
RMSD bond length | 0.028 |
RMSD bond angle | 2.367 |
Data reduction software | XDS |
Data scaling software | XDS |
Phasing software | MOLREP |
Refinement software | REFMAC (5.5.0110) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 48.000 | 1.600 |
High resolution limit [Å] | 1.500 | 1.500 |
Rmerge | 0.054 | 0.364 |
Number of reflections | 50946 | |
<I/σ(I)> | 20.6 | 4.6 |
Completeness [%] | 91.2 | 61.4 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION | 7.5 | 298 | 0.1 M HEPES pH 7.5, 10 % (v/v) 2-Propanol, 20 % (w/v) PEG 4000, VAPOR DIFFUSION, temperature 298K |