4DK0
Crystal structure of MacA from Actinobacillus actinomycetemcomitans
Experimental procedure
Experimental method | MAD |
Source type | SYNCHROTRON |
Source details | PAL/PLS BEAMLINE 6C1 |
Synchrotron site | PAL/PLS |
Beamline | 6C1 |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2008-01-15 |
Detector | ADSC QUANTUM 210 |
Wavelength(s) | 1.0000, 0.9794, 0.9796, 1.1271 |
Spacegroup name | P 6 2 2 |
Unit cell lengths | 109.188, 109.188, 255.442 |
Unit cell angles | 90.00, 90.00, 120.00 |
Refinement procedure
Resolution | 9.991 - 3.500 |
R-factor | 0.3435 |
Rwork | 0.338 |
R-free | 0.38990 |
Structure solution method | MAD |
RMSD bond length | 0.015 |
RMSD bond angle | 2.095 |
Data reduction software | HKL-2000 |
Data scaling software | HKL-2000 |
Phasing software | SOLVE |
Refinement software | PHENIX ((phenix.refine: 1.7.2_869)) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 50.000 | 3.110 |
High resolution limit [Å] | 3.000 | 3.000 |
Number of reflections | 17810 | |
Completeness [%] | 97.2 | 87.1 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | EVAPORATION | 8.5 | 277 | 0.01M Nickel chloride, 0.1M Tris-HCl, 1M Lithium Sulfate, pH 8.5, EVAPORATION, temperature 277K |