6E6Y
Dieckmann cyclase, NcmC
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | APS BEAMLINE 21-ID-G |
| Synchrotron site | APS |
| Beamline | 21-ID-G |
| Temperature [K] | 100 |
| Detector technology | CCD |
| Collection date | 2015-08-22 |
| Detector | MARMOSAIC 300 mm CCD |
| Wavelength(s) | 0.97858 |
| Spacegroup name | P 41 |
| Unit cell lengths | 80.435, 80.435, 77.923 |
| Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
| Resolution | 80.430 - 1.600 |
| R-factor | 0.17046 |
| Rwork | 0.169 |
| R-free | 0.20396 |
| Structure solution method | SAD |
| RMSD bond length | 0.021 |
| RMSD bond angle | 2.056 |
| Data reduction software | XDS |
| Data scaling software | autoPROC |
| Phasing software | AutoSol |
| Refinement software | REFMAC (5.8.0189) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 80.430 | 1.657 |
| High resolution limit [Å] | 1.600 | 1.600 |
| Rmerge | 0.087 | 0.690 |
| Number of reflections | 64619 | 5773 |
| <I/σ(I)> | 9.8 | |
| Completeness [%] | 99.0 | |
| Redundancy | 13.3 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 7 | 282 | 1.75 M ammonium sulfate, 1.9% (w/v) PEG 400, 0.1 M HEPES pH 7.0, 3 mM DTT |
