7RC2
Aeronamide N-methyltransferase, AerE
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | APS BEAMLINE 21-ID-D |
| Synchrotron site | APS |
| Beamline | 21-ID-D |
| Temperature [K] | 100 |
| Detector technology | PIXEL |
| Collection date | 2017-10-12 |
| Detector | DECTRIS EIGER X 9M |
| Wavelength(s) | 0.97851 |
| Spacegroup name | P 32 2 1 |
| Unit cell lengths | 77.566, 77.566, 152.314 |
| Unit cell angles | 90.00, 90.00, 120.00 |
Refinement procedure
| Resolution | 40.500 - 1.510 |
| R-factor | 0.162 |
| Rwork | 0.161 |
| R-free | 0.17540 |
| Structure solution method | SAD |
| Data reduction software | XDS |
| Data scaling software | Aimless |
| Phasing software | AutoSol |
| Refinement software | PHENIX (1.19.2_4158) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 67.174 | 1.534 |
| High resolution limit [Å] | 1.508 | 1.508 |
| Rmerge | 0.077 | 1.151 |
| Rpim | 0.018 | 0.280 |
| Number of reflections | 84396 | 4170 |
| <I/σ(I)> | 23.2 | |
| Completeness [%] | 100.0 | 100 |
| Redundancy | 20.2 | 17.6 |
| CC(1/2) | 1.000 | 0.854 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 6.5 | 282 | 40% PEG 300, 0.1 M sodium cacodylate pH 6.5, 0.2 M calcium acetate |
