3A2L
Crystal structure of DBJA (mutant dbja delta)
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | PHOTON FACTORY BEAMLINE AR-NW12A |
Synchrotron site | Photon Factory |
Beamline | AR-NW12A |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2005-11-25 |
Detector | ADSC QUANTUM 210 |
Wavelength(s) | 0.978 |
Spacegroup name | C 1 2 1 |
Unit cell lengths | 125.547, 48.652, 106.816 |
Unit cell angles | 90.00, 97.39, 90.00 |
Refinement procedure
Resolution | 43.190 - 1.780 |
R-factor | 0.171 |
Rwork | 0.169 |
R-free | 0.20500 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 3A1O |
RMSD bond length | 0.013 |
RMSD bond angle | 1.403 |
Data reduction software | HKL-2000 |
Data scaling software | SCALEPACK |
Refinement software | REFMAC (5.2.0005) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 50.000 | 1.840 |
High resolution limit [Å] | 1.780 | 1.780 |
Rmerge | 0.072 | 0.349 |
Number of reflections | 60942 | |
<I/σ(I)> | 10.8 | |
Completeness [%] | 98.6 | 92.4 |
Redundancy | 3.5 | 2.7 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 7.9 | 293 | PEG 4000, PH 7.9, VAPOR DIFFUSION, HANGING DROP, TEMPERATURE 293K |