9LA8
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 | 2023-07-01 |
| Detector | DECTRIS PILATUS3 6M |
| Wavelength(s) | 0.97853 |
| Spacegroup name | P 1 21 1 |
| Unit cell lengths | 60.401, 101.708, 62.433 |
| Unit cell angles | 90.00, 102.55, 90.00 |
Refinement procedure
| Resolution | 38.510 - 1.560 |
| R-factor | 0.1604 |
| Rwork | 0.160 |
| R-free | 0.18390 |
| Structure solution method | MOLECULAR REPLACEMENT |
| RMSD bond length | 0.007 |
| RMSD bond angle | 1.127 |
| Data reduction software | HKL-3000 |
| Data scaling software | HKL-3000 |
| Phasing software | PHENIX |
| Refinement software | PHENIX (1.19.1_4122) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 58.960 | 1.360 |
| High resolution limit [Å] | 1.290 | 1.290 |
| Number of reflections | 104403 | 10376 |
| <I/σ(I)> | 11.1 | |
| Completeness [%] | 100.0 | |
| Redundancy | 5.8 | |
| CC(1/2) | 0.993 | 0.873 |
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 |
