5DP1
Crystal structure of CurK enoyl reductase
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | APS BEAMLINE 23-ID-B |
Synchrotron site | APS |
Beamline | 23-ID-B |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2010-08-19 |
Detector | MARMOSAIC 300 mm CCD |
Wavelength(s) | 1.0332 |
Spacegroup name | F 2 2 2 |
Unit cell lengths | 93.583, 127.153, 127.759 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 24.300 - 1.850 |
R-factor | 0.1872 |
Rwork | 0.185 |
R-free | 0.22004 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 2vz9 |
RMSD bond length | 0.008 |
RMSD bond angle | 1.146 |
Data reduction software | HKL-2000 |
Data scaling software | HKL-2000 |
Phasing software | BALBES |
Refinement software | REFMAC (5.8.0073) |
Data quality characteristics
Overall | |
Low resolution limit [Å] | 24.300 |
High resolution limit [Å] | 1.850 |
Rmerge | 0.059 |
Number of reflections | 32609 |
<I/σ(I)> | 21 |
Completeness [%] | 99.0 |
Redundancy | 3.8 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, SITTING DROP | 293.15 | 1.2 M NaH2PO4, 0.8 M K2HPO4, 0.2 M Li2SO4 and 0.1 M CAPS pH 10.5 |