1WKQ
Crystal Structure of Bacillus subtilis Guanine Deaminase. The first domain-swapped structure in the cytidine deaminase superfamily
Experimental procedure
Experimental method | MAD |
Source type | SYNCHROTRON |
Source details | SPRING-8 BEAMLINE BL12B2 |
Synchrotron site | SPring-8 |
Beamline | BL12B2 |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2004-02-03 |
Detector | ADSC QUANTUM 4 |
Wavelength(s) | 1.0, 0.9798, 0.9799, 0.9571 |
Spacegroup name | C 2 2 21 |
Unit cell lengths | 81.566, 91.267, 80.481 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 30.000 - 1.170 |
Rwork | 0.161 |
R-free | 0.17700 |
Structure solution method | MAD |
RMSD bond length | 0.013 |
RMSD bond angle | 1.600 |
Data reduction software | HKL-2000 |
Data scaling software | SCALEPACK |
Phasing software | SOLVE |
Refinement software | CNS (1.0) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 30.000 | 1.170 |
High resolution limit [Å] | 1.150 | 1.150 |
Rmerge | 0.057 | 0.280 |
Number of reflections | 99896 | |
<I/σ(I)> | 36.3 | 3.8 |
Completeness [%] | 93.9 | 59 |
Redundancy | 10.8 | 3.5 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 6.5 | 295 | polyethylene glycol 4000, ammonium acetate, sodium citrate , pH 6.5, VAPOR DIFFUSION, HANGING DROP, temperature 295K |