4Y42
Cyanase (CynS) from Serratia proteamaculans
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | NSLS BEAMLINE X6A |
| Synchrotron site | NSLS |
| Beamline | X6A |
| Temperature [K] | 100 |
| Detector technology | PIXEL |
| Collection date | 2013-07-15 |
| Detector | DECTRIS PILATUS 6M-F |
| Wavelength(s) | 1.0 |
| Spacegroup name | P 1 |
| Unit cell lengths | 82.549, 82.456, 87.985 |
| Unit cell angles | 98.56, 117.38, 110.46 |
Refinement procedure
| Resolution | 47.048 - 2.090 |
| R-factor | 0.1524 |
| Rwork | 0.150 |
| R-free | 0.19970 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 1dw9 |
| RMSD bond length | 0.008 |
| RMSD bond angle | 1.098 |
| Data reduction software | XDS |
| Data scaling software | XSCALE |
| Phasing software | PHASER (2.5.2) |
| Refinement software | PHENIX ((phenix.refine: 1.9_1692)) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 50.000 | 2.220 |
| High resolution limit [Å] | 2.090 | 2.090 |
| Rmerge | 0.050 | 0.320 |
| Number of reflections | 98524 | |
| <I/σ(I)> | 11.38 | 2.3 |
| Completeness [%] | 92.5 | 86.8 |
| Redundancy | 1.8 | 1.8 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, SITTING DROP | 295 | 0.1 M HEPES pH 7.5, 2% (v/v) 2-propanol, 0.1 M sodium acetate, 18% (w/v) PEG8000 |
