4U1R
ATP-bound structure of human platelet phosphofructokinase in an R-state, crystal form II
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | BESSY BEAMLINE 14.1 |
| Synchrotron site | BESSY |
| Beamline | 14.1 |
| Temperature [K] | 100 |
| Detector technology | PIXEL |
| Collection date | 2013-10-13 |
| Detector | DECTRIS PILATUS 6M |
| Wavelength(s) | 0.91841 |
| Spacegroup name | P 32 2 1 |
| Unit cell lengths | 132.896, 132.896, 399.105 |
| Unit cell angles | 90.00, 90.00, 120.00 |
Refinement procedure
| Resolution | 47.010 - 2.800 |
| R-factor | 0.16392 |
| Rwork | 0.162 |
| R-free | 0.19825 |
| Structure solution method | MOLECULAR REPLACEMENT |
| RMSD bond length | 0.011 |
| RMSD bond angle | 1.470 |
| Data reduction software | XDS |
| Data scaling software | XSCALE (2.5.0) |
| Phasing software | PHASER |
| Refinement software | REFMAC (5.8.0073) |
Data quality characteristics
| Overall | Inner shell | Outer shell | |
| Low resolution limit [Å] | 50.000 | 2.970 | |
| High resolution limit [Å] | 2.800 | 8.280 | 2.800 |
| Rmerge | 0.221 | 0.046 | 1.286 |
| Rmeas | 0.236 | 0.049 | 1.373 |
| Total number of observations | 796444 | ||
| Number of reflections | 101291 | 4140 | 16122 |
| <I/σ(I)> | 9.53 | 38.07 | 1.75 |
| Completeness [%] | 99.7 | 97.5 | 99.5 |
| Redundancy | 7.9 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 6 | 292 | 0.1 M MES, 17-23% v/v MPD |
