5KPZ
PANK3-ADP-PhosphoPantothenate 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 | 2015-12-16 |
Detector | RAYONIX MX300-HS |
Wavelength(s) | 1.0 |
Spacegroup name | P 31 2 1 |
Unit cell lengths | 99.488, 99.488, 68.542 |
Unit cell angles | 90.00, 90.00, 120.00 |
Refinement procedure
Resolution | 36.474 - 2.400 |
R-factor | 0.1756 |
Rwork | 0.173 |
R-free | 0.21590 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 5kpr |
RMSD bond length | 0.010 |
RMSD bond angle | 0.858 |
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] | 36.474 | 2.460 |
High resolution limit [Å] | 2.400 | 2.400 |
Rmerge | 0.086 | 0.447 |
Number of reflections | 15535 | |
<I/σ(I)> | 29.6 | 2.9 |
Completeness [%] | 98.7 | 89.8 |
Redundancy | 8.3 | 5.5 |
CC(1/2) | 0.898 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, SITTING DROP | 5.6 | 291.15 | PEG 4000, ammonium acetate, citrate |