6IE3
Crystal structure of methyladenine demethylase
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | SSRF BEAMLINE BL19U1 |
| Synchrotron site | SSRF |
| Beamline | BL19U1 |
| Temperature [K] | 100 |
| Detector technology | PIXEL |
| Collection date | 2017-01-30 |
| Detector | DECTRIS PILATUS 6M |
| Wavelength(s) | 0.97929 |
| Spacegroup name | P 65 |
| Unit cell lengths | 56.732, 56.732, 191.686 |
| Unit cell angles | 90.00, 90.00, 120.00 |
Refinement procedure
| Resolution | 49.130 - 1.970 |
| R-factor | 0.20398 |
| Rwork | 0.203 |
| R-free | 0.23310 |
| Structure solution method | SAD |
| RMSD bond length | 0.007 |
| RMSD bond angle | 1.181 |
| Data reduction software | HKL-3000 |
| Data scaling software | HKL-3000 |
| Phasing software | AutoSol |
| Refinement software | REFMAC (5.8.0158) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 50.000 | 2.000 |
| High resolution limit [Å] | 1.970 | 1.970 |
| Rmerge | 0.095 | 0.746 |
| Rmeas | 0.099 | 0.783 |
| Rpim | 0.026 | 0.232 |
| Number of reflections | 24558 | 621 |
| <I/σ(I)> | 23.1 | |
| Completeness [%] | 99.4 | |
| Redundancy | 15.3 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 7.5 | 286 | 5% ethanol, 5% MPD, 100 mM NaF, 100 mM HepespH7.5 |
