5KPR
PANK3-AMPPNP-Pantothenate 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 | 2015-06-14 |
| Detector | RAYONIX MX300-HS |
| Wavelength(s) | 0.971 |
| Spacegroup name | P 31 2 1 |
| Unit cell lengths | 98.965, 98.965, 68.783 |
| Unit cell angles | 90.00, 90.00, 120.00 |
Refinement procedure
| Resolution | 36.372 - 1.827 |
| R-factor | 0.1721 |
| Rwork | 0.171 |
| R-free | 0.19330 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | PDB 3SMS |
| RMSD bond length | 0.007 |
| RMSD bond angle | 0.962 |
| 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] | 36.372 | 1.880 |
| High resolution limit [Å] | 1.827 | 1.830 |
| Rmerge | 0.087 | 0.466 |
| Number of reflections | 34465 | |
| <I/σ(I)> | 23.5 | 2.2 |
| Completeness [%] | 99.1 | 91.2 |
| Redundancy | 6.7 | 4.9 |
| CC(1/2) | 0.842 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, SITTING DROP | 5.6 | 291.15 | PEG 4000, ammonium acetate, citrate |
