5YBQ
Fe(II)/(alpha)ketoglutarate-dependent dioxygenase PrhA-V150L/A232S in complex with preaustinoid A2
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | NSRRC BEAMLINE BL17A |
Synchrotron site | NSRRC |
Beamline | BL17A |
Temperature [K] | 95 |
Detector technology | PIXEL |
Collection date | 2016-12-04 |
Detector | DECTRIS PILATUS3 S 6M |
Wavelength(s) | 0.98 |
Spacegroup name | P 62 |
Unit cell lengths | 171.361, 171.361, 45.559 |
Unit cell angles | 90.00, 90.00, 120.00 |
Refinement procedure
Resolution | 43.553 - 2.250 |
R-factor | 0.2098 |
Rwork | 0.207 |
R-free | 0.25500 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 5ybm |
RMSD bond length | 0.008 |
RMSD bond angle | 0.942 |
Data scaling software | Aimless |
Phasing software | PHENIX ((1.10.1_2155)) |
Refinement software | PHENIX ((1.10.1_2155)) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 49.000 | 2.320 |
High resolution limit [Å] | 2.250 | 2.250 |
Number of reflections | 36757 | |
<I/σ(I)> | 14.3 | |
Completeness [%] | 99.8 | |
Redundancy | 5 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, SITTING DROP | 293 | PEG 3350, lithium citrate |