4PSJ
Crystal Structure of Engineered Protein. Northeast Structural Genomics Consortium (NESG) Target OR464.
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | NSLS BEAMLINE X4A |
| Synchrotron site | NSLS |
| Beamline | X4A |
| Temperature [K] | 100 |
| Detector technology | CCD |
| Collection date | 2014-02-26 |
| Detector | ADSC QUANTUM 4 |
| Wavelength(s) | 0.97942 |
| Spacegroup name | P 1 21 1 |
| Unit cell lengths | 31.916, 51.455, 69.005 |
| Unit cell angles | 90.00, 90.98, 90.00 |
Refinement procedure
| Resolution | 31.911 - 1.992 |
| R-factor | 0.184 |
| Rwork | 0.181 |
| R-free | 0.24400 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 3rfj |
| RMSD bond length | 0.007 |
| RMSD bond angle | 1.054 |
| Data reduction software | HKL-2000 |
| Data scaling software | HKL-2000 |
| Phasing software | BALBES |
| Refinement software | PHENIX (1.7.2_869) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 50.000 | 2.070 |
| High resolution limit [Å] | 2.000 | 2.000 |
| Rmerge | 0.084 | 0.170 |
| Number of reflections | 28015 | |
| <I/σ(I)> | 25.6 | 5.9 |
| Completeness [%] | 93.8 | 68.1 |
| Redundancy | 3.5 | 2.4 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | Microbatch crystallization under oil | 5.5 | 291 | Protein solution: 100mM NaCl, 5mM DTT, 0.02% NaN3, 10mM Tris-HCl (pH 7.5). Reservoir solution: 25% PEG 3350, 0.1M Bis-Tris, Microbatch crystallization under oil, temperature 291K |
