2XAO
Inositol 1,3,4,5,6-pentakisphosphate 2-kinase from A. thaliana in complex with IP5
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | ESRF BEAMLINE ID23-2 |
| Synchrotron site | ESRF |
| Beamline | ID23-2 |
| Temperature [K] | 120 |
| Detector technology | CCD |
| Detector | MARRESEARCH |
| Spacegroup name | P 21 21 21 |
| Unit cell lengths | 58.761, 112.737, 144.454 |
| Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
| Resolution | 88.736 - 2.900 |
| R-factor | 0.228 |
| Rwork | 0.225 |
| R-free | 0.29070 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 2xam |
| RMSD bond length | 0.010 |
| RMSD bond angle | 1.371 |
| Data reduction software | MOSFLM |
| Data scaling software | CCP4 |
| Refinement software | REFMAC (5.2.0019) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 88.740 | 3.060 |
| High resolution limit [Å] | 2.700 | 2.900 |
| Rmerge | 0.130 | 0.450 |
| Number of reflections | 22033 | |
| <I/σ(I)> | 4.24 | 1.66 |
| Completeness [%] | 100.0 | 100 |
| Redundancy | 6.92 | 6.99 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | 5.9 | 22% PEG 3300, 100 MM BIS-TRIS PH 5.9, 2 MM MGCL2. PROTEIN WAS MIXED WITH 2 MM INOSITOL-5-P |
