2IDQ
Structure of M98A mutant of amicyanin, Cu(II)
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | APS BEAMLINE 14-BM-C |
Synchrotron site | APS |
Beamline | 14-BM-C |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2005-08-09 |
Detector | ADSC QUANTUM 315 |
Wavelength(s) | 0.90000 |
Spacegroup name | P 1 21 1 |
Unit cell lengths | 28.570, 56.160, 26.970 |
Unit cell angles | 90.00, 96.63, 90.00 |
Refinement procedure
Resolution | 30.000 - 0.900 |
R-factor | 0.1078 |
R-free | 0.13010 |
Structure solution method | FOURIER SYNTHESIS |
Starting model (for MR) | 1aac |
RMSD bond length | 0.016 |
RMSD bond angle | 0.033 |
Data reduction software | HKL-2000 |
Data scaling software | HKL-2000 |
Refinement software | SHELXL-97 |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 50.000 | 0.910 |
High resolution limit [Å] | 0.900 | 0.900 |
Rmerge | 0.086 | 0.279 |
Number of reflections | 52731 | |
<I/σ(I)> | 10.9 | |
Completeness [%] | 84.3 | 37.5 |
Redundancy | 6.6 | 2.2 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | EVAPORATION | 5.5 | 293 | 10 mg/ml amicyanin in 3.0 M phosphate, pH 5.5, EVAPORATION, temperature 293K |