4AXE
Inositol 1,3,4,5,6-pentakisphosphate 2-kinase in complex with ADP
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | ESRF BEAMLINE ID14-4 |
| Synchrotron site | ESRF |
| Beamline | ID14-4 |
| Temperature [K] | 100 |
| Detector technology | CCD |
| Detector | ADSC CCD |
| Spacegroup name | P 21 21 2 |
| Unit cell lengths | 100.620, 71.920, 63.720 |
| Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
| Resolution | 39.490 - 2.500 |
| R-factor | 0.22656 |
| Rwork | 0.224 |
| R-free | 0.28624 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 2xan |
| RMSD bond length | 0.005 |
| RMSD bond angle | 1.045 |
| Data reduction software | MOSFLM |
| Data scaling software | SCALA |
| Phasing software | PHASER |
| Refinement software | REFMAC (5.6.0117) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 39.490 | 2.640 |
| High resolution limit [Å] | 2.500 | 2.500 |
| Rmerge | 0.100 | 0.410 |
| Number of reflections | 16575 | |
| <I/σ(I)> | 10.1 | 3.6 |
| Completeness [%] | 99.8 | 100 |
| Redundancy | 4.6 | 4.8 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | 5.6 | 0.5 M NH4SO2, 0.1 M NA CITRATE TRIBASIC DIHYDRATE, PH 5.6, AND 0.8 M LISO4 |
