5YM3
CYP76AH1-4pi from salvia miltiorrhiza
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | SSRF BEAMLINE BL17U1 |
| Synchrotron site | SSRF |
| Beamline | BL17U1 |
| Temperature [K] | 93 |
| Detector technology | CCD |
| Collection date | 2015-11-30 |
| Detector | ADSC QUANTUM 315r |
| Wavelength(s) | 0.97979 |
| Spacegroup name | P 31 2 1 |
| Unit cell lengths | 109.103, 109.103, 105.709 |
| Unit cell angles | 90.00, 90.00, 120.00 |
Refinement procedure
| Resolution | 43.132 - 2.601 |
| R-factor | 0.1873 |
| Rwork | 0.185 |
| R-free | 0.23060 |
| RMSD bond length | 0.006 |
| RMSD bond angle | 0.929 |
| Data reduction software | HKL-2000 |
| Data scaling software | HKL-2000 |
| Phasing software | REFMAC |
| Refinement software | PHENIX (1.9_1692) |
Data quality characteristics
| Overall | |
| Low resolution limit [Å] | 50.000 |
| High resolution limit [Å] | 2.600 |
| Number of reflections | 22668 |
| <I/σ(I)> | 16 |
| Completeness [%] | 99.4 |
| Redundancy | 5.8 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION | 289 | HEPES, Jeffamine M-600 Reagent, manganese chloride |
