5KP6
Crystal Structure of the Curacin Biosynthetic Pathway HMG Synthase in Complex with Apo Donor-ACP
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 | PIXEL |
Collection date | 2014-11-06 |
Detector | DECTRIS PILATUS3 6M |
Wavelength(s) | 1.033 |
Spacegroup name | P 31 2 1 |
Unit cell lengths | 101.312, 101.312, 104.593 |
Unit cell angles | 90.00, 90.00, 120.00 |
Refinement procedure
Resolution | 87.740 - 2.050 |
R-factor | 0.1572 |
Rwork | 0.155 |
R-free | 0.19320 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 5kp5 |
RMSD bond length | 0.011 |
RMSD bond angle | 1.476 |
Data reduction software | XDS |
Data scaling software | XDS |
Phasing software | REFMAC |
Refinement software | REFMAC (5.8.0073) |
Data quality characteristics
Overall | |
Low resolution limit [Å] | 87.740 |
High resolution limit [Å] | 2.050 |
Rmerge | 0.117 |
Number of reflections | 39403 |
<I/σ(I)> | 19.1 |
Completeness [%] | 100.0 |
Redundancy | 19.5 |
CC(1/2) | 0.990 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION | 6.5 | 293 | 6% PEG 8000, 60 mM (NH4)2SO4, 1X MMT pH 6.5 |