3Q8J
Crystal Structure of Asteropsin A from Marine Sponge Asteropus sp.
Experimental procedure
| Experimental method | \f and \w scans |
| Source type | SEALED TUBE |
| Source details | OTHER |
| Temperature [K] | 90 |
| Detector technology | CCD |
| Collection date | 2010-11-05 |
| Detector | APEX II CCD |
| Wavelength(s) | 1.54178 |
| Spacegroup name | P 1 |
| Unit cell lengths | 14.803, 18.557, 24.178 |
| Unit cell angles | 83.19, 84.10, 68.04 |
Refinement procedure
| Resolution | 17.150 - 0.870 |
| RMSD bond length | 0.000 |
| RMSD bond angle | 0.000 |
| Refinement software | SHELX |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 17.150 | 0.970 |
| High resolution limit [Å] | 0.870 | 0.870 |
| Rmerge | 0.048 | 0.157 |
| Number of reflections | 27756 | |
| <I/σ(I)> | 11.68 | 4.4 |
| Completeness [%] | 97.7 | 60.5 |
| Redundancy | 2.41 | 1 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | 295 | CD3OH-H2O, NMR tube, temperature 295K |
