5U89
Crystal structure of a cross-module fragment from the dimodular NRPS DhbF
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | CLSI BEAMLINE 08ID-1 |
Synchrotron site | CLSI |
Beamline | 08ID-1 |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2015-10-07 |
Detector | RAYONIX MX-300 |
Wavelength(s) | 0.9795 |
Spacegroup name | P 65 2 2 |
Unit cell lengths | 119.510, 119.510, 589.647 |
Unit cell angles | 90.00, 90.00, 120.00 |
Refinement procedure
Resolution | 58.564 - 3.075 |
R-factor | 0.2184 |
Rwork | 0.216 |
R-free | 0.25880 |
RMSD bond length | 0.003 |
RMSD bond angle | 0.616 |
Data reduction software | iMOSFLM |
Data scaling software | SCALA |
Phasing software | PHENIX |
Refinement software | PHENIX (1.9_1692) |
Data quality characteristics
Overall | |
Low resolution limit [Å] | 58.560 |
High resolution limit [Å] | 3.075 |
Rmerge | 0.069 |
Number of reflections | 47171 |
<I/σ(I)> | 5.04 |
Completeness [%] | 98.6 |
Redundancy | 2 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, SITTING DROP | 5.5 | 295 | 1.6 M ammonium sulfate, 0.1 M Bis-Tris pH 5, 2 mM EDTA, 0.008% (v/v) octyl-beta-D galactoside |