9W1K
Crystal structure of Aedes aegypti Dopachrome Conversion Enzyme.
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | NSLS BEAMLINE X29A |
| Synchrotron site | NSLS |
| Beamline | X29A |
| Temperature [K] | 100 |
| Detector technology | CCD |
| Collection date | 2007-07-02 |
| Detector | ADSC QUANTUM 315 |
| Wavelength(s) | 1.0809 |
| Spacegroup name | P 1 21 1 |
| Unit cell lengths | 88.760, 105.073, 101.404 |
| Unit cell angles | 90.00, 109.97, 90.00 |
Refinement procedure
| Resolution | 29.900 - 2.900 |
| R-factor | 0.21028 |
| Rwork | 0.208 |
| R-free | 0.25561 |
| Structure solution method | MOLECULAR REPLACEMENT |
| RMSD bond length | 0.005 |
| RMSD bond angle | 1.038 |
| Data reduction software | HKL-2000 |
| Data scaling software | SCALEPACK |
| Phasing software | MOLREP |
| Refinement software | REFMAC (5.7.0029) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 30.000 | 3.000 |
| High resolution limit [Å] | 2.900 | 2.900 |
| Rmerge | 0.090 | 0.310 |
| Number of reflections | 38871 | 2370 |
| <I/σ(I)> | 14.3 | |
| Completeness [%] | 93.1 | 58.6 |
| Redundancy | 6.8 | 4.3 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 6.5 | 277 | 0.2 M Calcium acetate hydrate 0.1 M Sodium cacodylate trihydrate pH 6.5 18% w/v Polyethylene glycol 8,000 |
