5DOV
Crystal structure of JamJ enoyl reductase (apo form)
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 | 2011-06-15 |
| Detector | MARMOSAIC 300 mm CCD |
| Wavelength(s) | 1.0332 |
| Spacegroup name | P 1 |
| Unit cell lengths | 50.905, 57.166, 66.132 |
| Unit cell angles | 95.27, 106.75, 105.12 |
Refinement procedure
| Resolution | 46.500 - 1.800 |
| R-factor | 0.18575 |
| Rwork | 0.184 |
| R-free | 0.22340 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 5dp1 |
| RMSD bond length | 0.009 |
| RMSD bond angle | 1.343 |
| Data reduction software | HKL-2000 |
| Data scaling software | HKL-2000 |
| Phasing software | PHASER |
| Refinement software | REFMAC (5.8.0073) |
Data quality characteristics
| Overall | |
| Low resolution limit [Å] | 46.500 |
| High resolution limit [Å] | 1.800 |
| Rmerge | 0.074 |
| Number of reflections | 63164 |
| <I/σ(I)> | 14.2 |
| Completeness [%] | 95.2 |
| Redundancy | 2.2 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, SITTING DROP | 293.15 | 30% PEG 4000, 0.2 M MgCl2 and 0.1 M Tris pH 8.5 |
