9KW8
Polyether epoxide hydrolase MonBI-MonBII complex with product analogue
This is a non-PDB format compatible entry.
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | PHOTON FACTORY BEAMLINE BL-1A |
| Synchrotron site | Photon Factory |
| Beamline | BL-1A |
| Temperature [K] | 100 |
| Detector technology | PIXEL |
| Collection date | 2014-01-19 |
| Detector | DECTRIS PILATUS 2M |
| Wavelength(s) | 1.1 |
| Spacegroup name | P 21 21 21 |
| Unit cell lengths | 103.920, 135.008, 144.516 |
| Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
| Resolution | 45.370 - 3.140 |
| R-factor | 0.218 |
| Rwork | 0.216 |
| R-free | 0.26640 |
| Structure solution method | MOLECULAR REPLACEMENT |
| RMSD bond length | 0.003 |
| RMSD bond angle | 0.627 |
| Data reduction software | XDS |
| Data scaling software | Aimless |
| Phasing software | MOLREP |
| Refinement software | PHENIX (1.20.1_4487) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 48.490 | 3.380 |
| High resolution limit [Å] | 3.140 | 3.140 |
| Rmerge | 0.173 | 0.658 |
| Rmeas | 0.192 | 0.807 |
| Rpim | 0.081 | 0.461 |
| Number of reflections | 35748 | 4551 |
| <I/σ(I)> | 5.9 | 1.7 |
| Completeness [%] | 99.0 | 99 |
| Redundancy | 5.5 | 5.2 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 4.8 | 293 | 1.4 M ammonium formate |
