5IQU
WelO5 G166D variant bound to Fe(II), 2-oxoglutarate, and 12-epifischerindole U
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | APS BEAMLINE 21-ID-G |
Synchrotron site | APS |
Beamline | 21-ID-G |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2015-02-15 |
Detector | MARMOSAIC 300 mm CCD |
Wavelength(s) | 1.03 |
Spacegroup name | C 1 2 1 |
Unit cell lengths | 74.107, 54.127, 74.639 |
Unit cell angles | 90.00, 90.79, 90.00 |
Refinement procedure
Resolution | 50.000 - 2.510 |
R-factor | 0.225 |
Rwork | 0.223 |
R-free | 0.26190 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 5iqs |
RMSD bond length | 0.005 |
RMSD bond angle | 1.039 |
Data reduction software | HKL-2000 |
Data scaling software | HKL-2000 |
Phasing software | PHASER |
Refinement software | REFMAC (5.8.0073) |
Data quality characteristics
Overall | Inner shell | Outer shell | |
Low resolution limit [Å] | 50.000 | 50.000 | 2.540 |
High resolution limit [Å] | 2.500 | 6.780 | 2.500 |
Rmerge | 0.056 | 0.035 | 0.292 |
Number of reflections | 8378 | ||
<I/σ(I)> | 9.7 | ||
Completeness [%] | 99.0 | 99.6 | 92.7 |
Redundancy | 3.6 | 3.6 | 3.2 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 293 | 20% PEG 3350, 0.1 M Bis-tris pH 5.5, 0.1 M sodium acetate pH 4.5 |