5DP2
CurF ER cyclopropanase from curacin A biosynthetic pathway
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | APS BEAMLINE 23-ID-D |
Synchrotron site | APS |
Beamline | 23-ID-D |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2012-10-11 |
Detector | MARMOSAIC 300 mm CCD |
Wavelength(s) | 0.72932 |
Spacegroup name | C 1 2 1 |
Unit cell lengths | 108.906, 47.294, 76.902 |
Unit cell angles | 90.00, 123.44, 90.00 |
Refinement procedure
Resolution | 30.000 - 0.960 |
R-factor | 0.11724 |
Rwork | 0.117 |
R-free | 0.13058 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 5doz |
RMSD bond length | 0.010 |
RMSD bond angle | 1.513 |
Data reduction software | XDS |
Data scaling software | XSCALE |
Phasing software | PHASER |
Refinement software | REFMAC (5.8.0073) |
Data quality characteristics
Overall | |
Low resolution limit [Å] | 30.000 |
High resolution limit [Å] | 0.960 |
Rmerge | 0.080 |
Number of reflections | 197326 |
<I/σ(I)> | 9.5 |
Completeness [%] | 99.4 |
Redundancy | 3.7 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, SITTING DROP | 293.15 | 0.1 M HEPES pH 7.5, 28% PEG 3350 |