6K3C
Crystal structure of class I PHA synthase (PhaC) mutant from Chromobacterium sp. USM2 bound to Coenzyme A.
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | SPRING-8 BEAMLINE BL41XU |
| Synchrotron site | SPring-8 |
| Beamline | BL41XU |
| Temperature [K] | 100 |
| Detector technology | PIXEL |
| Collection date | 2016-10-25 |
| Detector | DECTRIS PILATUS 6M |
| Wavelength(s) | 0.97914 |
| Spacegroup name | C 1 2 1 |
| Unit cell lengths | 169.802, 61.852, 82.566 |
| Unit cell angles | 90.00, 106.73, 90.00 |
Refinement procedure
| Resolution | 49.953 - 3.074 |
| R-factor | 0.2261 |
| Rwork | 0.224 |
| R-free | 0.26270 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 5xav |
| RMSD bond length | 0.004 |
| RMSD bond angle | 0.699 |
| Data reduction software | HKL-2000 |
| Data scaling software | HKL-2000 |
| Phasing software | PHENIX ((1.11.1_2575)) |
| Refinement software | PHENIX ((1.11.1_2575)) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 50.000 | 3.150 |
| High resolution limit [Å] | 3.074 | 3.074 |
| Rmerge | 0.079 | 0.513 |
| Number of reflections | 15234 | 1912 |
| <I/σ(I)> | 15.2 | |
| Completeness [%] | 96.5 | 87.5 |
| Redundancy | 3.3 | 2.9 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 7 | 277.15 | Sodium acetate, PEG3350 |
