7D3A
flavone reductase
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 | 2019-06-19 |
Detector | DECTRIS PILATUS 6M |
Wavelength(s) | 0.97849 |
Spacegroup name | P 43 21 2 |
Unit cell lengths | 63.969, 63.969, 192.262 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 28.618 - 2.552 |
R-factor | 0.2005 |
Rwork | 0.194 |
R-free | 0.25790 |
Structure solution method | SAD |
RMSD bond length | 0.009 |
RMSD bond angle | 0.976 |
Data reduction software | HKL-3000 |
Data scaling software | HKL-3000 |
Phasing software | HKL-3000 |
Refinement software | PHENIX (1.10_2155) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 30.000 | 2.640 |
High resolution limit [Å] | 2.550 | 2.590 |
Number of reflections | 22019 | 12318 |
<I/σ(I)> | 28.67 | |
Completeness [%] | 99.9 | |
Redundancy | 23.1 | |
CC(1/2) | 0.887 | 0.887 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, SITTING DROP | 293 | 0.1 M magnesium formate dihydrate and 15 w/v polyethylene glycol 3350 |