2I1V
Crystal structure of PFKFB3 in complex with ADP and Fructose-2,6-bisphosphate
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | CAMD BEAMLINE GCPCC |
| Synchrotron site | CAMD |
| Beamline | GCPCC |
| Temperature [K] | 100 |
| Detector technology | CCD |
| Collection date | 2005-04-13 |
| Detector | MAR CCD 165 mm |
| Wavelength(s) | 1.3808 |
| Spacegroup name | P 65 2 2 |
| Unit cell lengths | 102.140, 102.140, 259.440 |
| Unit cell angles | 90.00, 90.00, 120.00 |
Refinement procedure
| Resolution | 30.000 - 2.500 |
| R-factor | 0.24 |
| Rwork | 0.214 |
| R-free | 0.26200 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 2axn |
| RMSD bond length | 0.006 |
| RMSD bond angle | 1.300 |
| Data reduction software | HKL-2000 |
| Data scaling software | SCALEPACK |
| Phasing software | AMoRE |
| Refinement software | CNS (1.1) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 30.000 | 2.590 |
| High resolution limit [Å] | 2.500 | 2.500 |
| Rmerge | 0.110 | 0.535 |
| Number of reflections | 28580 | |
| <I/σ(I)> | 15.3 | 1.9 |
| Completeness [%] | 99.6 | 98.2 |
| Redundancy | 13.9 | 1.9 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, SITTING DROP | 7.5 | 298 | PEG 4000, ethylene glycol, Tris, phosphate, pH 7.5, VAPOR DIFFUSION, SITTING DROP, temperature 298K |
