5EP9
Crystal structure of the non-heme alpha ketoglutarate dependent epimerase SnoN from nogalamycin biosynthesis
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | ESRF BEAMLINE ID29 |
Synchrotron site | ESRF |
Beamline | ID29 |
Temperature [K] | 100 |
Detector technology | PIXEL |
Collection date | 2015-02-26 |
Detector | DECTRIS PILATUS 6M |
Wavelength(s) | 0.9724 |
Spacegroup name | P 1 21 1 |
Unit cell lengths | 52.207, 120.557, 102.879 |
Unit cell angles | 90.00, 92.54, 90.00 |
Refinement procedure
Resolution | 47.800 - 2.130 |
R-factor | 0.17725 |
Rwork | 0.176 |
R-free | 0.20312 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | ensemble of 2opw 2a1x 2fct |
RMSD bond length | 0.021 |
RMSD bond angle | 1.959 |
Data reduction software | iMOSFLM |
Data scaling software | Aimless |
Phasing software | PHASER |
Refinement software | REFMAC (5.8.0124) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 47.800 | 2.130 |
High resolution limit [Å] | 2.070 | 2.070 |
Rmerge | 0.077 | 0.995 |
Number of reflections | 76968 | |
<I/σ(I)> | 11.7 | 1.4 |
Completeness [%] | 99.5 | 99.5 |
Redundancy | 4.9 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 8 | 293 | PEG3350, ammonium acetate, Bis-Tris, ammonium ferric citrate, alpha ketoglutarate, sodium chloride |