4OAJ
Crystal structure of the complex between SAP97 PDZ2 and 5HT2A receptor peptide
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | DIAMOND BEAMLINE I03 |
| Synchrotron site | Diamond |
| Beamline | I03 |
| Temperature [K] | 100 |
| Detector technology | PIXEL |
| Collection date | 2012-12-12 |
| Detector | PSI PILATUS 6M |
| Wavelength(s) | 0.970000 |
| Spacegroup name | P 32 2 1 |
| Unit cell lengths | 45.000, 45.000, 88.110 |
| Unit cell angles | 90.00, 90.00, 120.00 |
Refinement procedure
| Resolution | 29.189 - 2.300 |
| R-factor | 0.2079 |
| Rwork | 0.205 |
| R-free | 0.25420 |
| Structure solution method | MOLECULAR REPLACEMENT |
| RMSD bond length | 0.008 |
| RMSD bond angle | 1.103 |
| Data reduction software | XDS |
| Data scaling software | XSCALE |
| Phasing software | PHASER |
| Refinement software | PHENIX ((phenix.refine: 1.8_1069)) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 29.189 | 2.350 |
| High resolution limit [Å] | 2.300 | 2.300 |
| Number of reflections | 4904 | |
| <I/σ(I)> | 17.71 | 3.76 |
| Completeness [%] | 99.5 | 97.7 |
| Redundancy | 8.85 | 8.64 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, SITTING DROP | 295 | 3.2M Ammonium Sulfate, 0.1M Citric Acid pH4.0, VAPOR DIFFUSION, SITTING DROP, temperature 295K |
