9LAC
Comparative analysis of functions and catalytic mechanisms of methyltransferases involved in anthracycline biosynthesis
This is a non-PDB format compatible entry.
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | SSRF BEAMLINE BL18U1 |
| Synchrotron site | SSRF |
| Beamline | BL18U1 |
| Temperature [K] | 100 |
| Detector technology | PIXEL |
| Collection date | 2024-03-20 |
| Detector | DECTRIS PILATUS3 6M |
| Wavelength(s) | 0.987 |
| Spacegroup name | P 21 21 21 |
| Unit cell lengths | 60.501, 104.553, 120.296 |
| Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
| Resolution | 33.049 - 1.700 |
| Rwork | 0.196 |
| R-free | 0.22180 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Data reduction software | HKL-3000 |
| Data scaling software | HKL-3000 |
| Phasing software | PHENIX |
| Refinement software | PHENIX (1.20.1) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 78.910 | 1.700 |
| High resolution limit [Å] | 1.620 | 1.620 |
| Number of reflections | 96054 | 12165 |
| <I/σ(I)> | 17.7 | |
| Completeness [%] | 97.7 | |
| Redundancy | 6.9 | |
| CC(1/2) | 0.999 | 0.901 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, SITTING DROP | 289 | 0.1 M BIS-TRIS (pH 5.5), 2.0 M Ammonium sulfate |
