2FQP
Crystal structure of a cupin domain (bp2299) from bordetella pertussis tohama i at 1.80 A resolution
Experimental procedure
Experimental method | MAD |
Source type | SYNCHROTRON |
Source details | ALS BEAMLINE 8.3.1 |
Synchrotron site | ALS |
Beamline | 8.3.1 |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2005-10-11 |
Detector | ADSC QUANTUM 210 |
Wavelength(s) | 1.019867, 0.979741 |
Spacegroup name | P 1 21 1 |
Unit cell lengths | 35.919, 92.651, 53.058 |
Unit cell angles | 90.00, 106.40, 90.00 |
Refinement procedure
Resolution | 19.000 - 1.800 |
R-factor | 0.156 |
Rwork | 0.154 |
R-free | 0.20200 |
Structure solution method | MAD |
RMSD bond length | 0.015 |
RMSD bond angle | 1.538 |
Data reduction software | MOSFLM |
Data scaling software | SCALA |
Phasing software | SOLVE |
Refinement software | REFMAC (5.2.0005) |
Data quality characteristics
Overall | Inner shell | Outer shell | |
Low resolution limit [Å] | 19.000 | 19.000 | 1.850 |
High resolution limit [Å] | 1.800 | 8.050 | 1.800 |
Rmerge | 0.064 | 0.036 | 0.302 |
Number of reflections | 27712 | ||
<I/σ(I)> | 11.2 | 25.46 | 2.24 |
Completeness [%] | 90.3 | ||
Redundancy | 4.1 | 4.2 | 4 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION,SITTING DROP,NANODROP | 8.5 | 277 | 0.2M NaOAc, 30.0% PEG-4000, 0.1M TRIS pH 8.5, VAPOR DIFFUSION,SITTING DROP,NANODROP, temperature 277K |