5GT7
Crystal Structure of Arg-bound CASTOR1
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | SSRF BEAMLINE BL17U |
| Synchrotron site | SSRF |
| Beamline | BL17U |
| Temperature [K] | 100 |
| Detector technology | CCD |
| Collection date | 2016-04-25 |
| Detector | ADSC QUANTUM 315r |
| Wavelength(s) | 1.0011 |
| Spacegroup name | P 1 21 1 |
| Unit cell lengths | 92.833, 83.146, 97.289 |
| Unit cell angles | 90.00, 116.39, 90.00 |
Refinement procedure
| Resolution | 33.029 - 2.048 |
| R-factor | 0.1862 |
| Rwork | 0.185 |
| R-free | 0.21120 |
| Structure solution method | SAD |
| RMSD bond length | 0.003 |
| RMSD bond angle | 0.674 |
| Data reduction software | HKL-3000 |
| Data scaling software | SCALEPACK |
| Phasing software | PHASER |
| Refinement software | PHENIX ((1.10.1_2155: ???)) |
Data quality characteristics
| Overall | Inner shell | Outer shell | |
| Low resolution limit [Å] | 50.000 | 50.000 | 2.120 |
| High resolution limit [Å] | 2.048 | 4.420 | 2.050 |
| Rmerge | 0.091 | 0.050 | 0.884 |
| Number of reflections | 82993 | ||
| <I/σ(I)> | 9.9 | ||
| Completeness [%] | 99.5 | 99.7 | 98.8 |
| Redundancy | 6.1 | 6.1 | 5.9 |
| CC(1/2) | 0.995 | 0.690 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION | 291 | 5 % (w/v) PEG3350, 0.1 M Na Malonate pH 5.0 |
