4AXF
InsP5 2-K in complex with Ins(3,4,5,6)P4 plus AMPPNP
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 |
| Collection date | 2010-09-09 |
| Detector | ADSC CCD |
| Spacegroup name | P 21 21 21 |
| Unit cell lengths | 61.620, 65.080, 122.490 |
| Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
| Resolution | 57.420 - 2.930 |
| R-factor | 0.22717 |
| Rwork | 0.225 |
| R-free | 0.27916 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 2xan |
| RMSD bond length | 0.005 |
| RMSD bond angle | 1.062 |
| 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] | 57.470 | 3.090 |
| High resolution limit [Å] | 2.930 | 2.930 |
| Rmerge | 0.150 | 0.400 |
| Number of reflections | 11132 | |
| <I/σ(I)> | 13.4 | 4.9 |
| Completeness [%] | 100.0 | 100 |
| Redundancy | 7 | 6.9 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | 5.9 | 21% PEG 3350, BIS-TRIS PH 5.9 |
