6KO1
The crystal structue of PDE10A complexed with 2d
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SEALED TUBE |
| Source details | OXFORD DIFFRACTION NOVA |
| Temperature [K] | 100 |
| Detector technology | CCD |
| Collection date | 2018-01-24 |
| Detector | OXFORD ONYX CCD |
| Wavelength(s) | 1.5418 |
| Spacegroup name | P 21 21 21 |
| Unit cell lengths | 49.763, 81.401, 161.233 |
| Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
| Resolution | 24.823 - 2.700 |
| R-factor | 0.2382 |
| Rwork | 0.233 |
| R-free | 0.33950 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 2oup |
| RMSD bond length | 0.010 |
| RMSD bond angle | 1.130 |
| Data reduction software | CrysalisPro (38.42) |
| Data scaling software | CrysalisPro (38.42) |
| Phasing software | PHASER (1.10) |
| Refinement software | PHENIX (1.10_2155) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 24.823 | 2.800 |
| High resolution limit [Å] | 2.700 | 2.700 |
| Rmerge | 0.145 | 0.380 |
| Number of reflections | 18454 | 1792 |
| <I/σ(I)> | 6.4 | 2.1 |
| Completeness [%] | 98.8 | 96.76 |
| Redundancy | 3.4 | 3.4 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION | 7.5 | 277 | 0.1 M Hepes (pH 7.5), 0.2 M MgCl2, 18% PEG 3350, 50 mM 2-mercaptoethanol |
