5KQD
PANK3:Palmitoyl-CoA complex
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | APS BEAMLINE 22-ID |
| Synchrotron site | APS |
| Beamline | 22-ID |
| Temperature [K] | 100 |
| Detector technology | CCD |
| Collection date | 2016-03-21 |
| Detector | RAYONIX MX300-HS |
| Wavelength(s) | 0.979 |
| Spacegroup name | P 2 3 |
| Unit cell lengths | 121.707, 121.707, 121.707 |
| Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
| Resolution | 38.487 - 2.600 |
| R-factor | 0.1966 |
| Rwork | 0.188 |
| R-free | 0.20860 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 3mk6 |
| RMSD bond length | 0.010 |
| RMSD bond angle | 1.150 |
| Data reduction software | HKL-2000 |
| Data scaling software | HKL-2000 |
| Phasing software | PHASER |
| Refinement software | PHENIX (1.10.1_2155) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 38.487 | 2.660 |
| High resolution limit [Å] | 2.600 | 2.600 |
| Rmerge | 0.091 | 0.968 |
| Number of reflections | 18791 | |
| <I/σ(I)> | 21.2 | 1.4 |
| Completeness [%] | 99.9 | 99.7 |
| Redundancy | 5.4 | 4.4 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, SITTING DROP | 7 | 291.15 | Ammonium sulfate, Tris, PEG 600, Glycerol |
