3GPR
Crystal structure of rhodocetin
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | SLS BEAMLINE X10SA |
| Synchrotron site | SLS |
| Beamline | X10SA |
| Wavelength(s) | 1.221 |
| Spacegroup name | P 65 |
| Unit cell lengths | 83.546, 83.546, 196.078 |
| Unit cell angles | 90.00, 90.00, 120.00 |
Refinement procedure
| Resolution | 29.780 - 3.200 |
| R-factor | 0.223 |
| Rwork | 0.223 |
| R-free | 0.28400 |
| Structure solution method | MOLECULAR REPLACEMENT |
| RMSD bond length | 0.008 |
| RMSD bond angle | 1.350 |
| Data reduction software | MOSFLM |
| Data scaling software | SCALA |
| Phasing software | PHASES |
| Refinement software | CNS (1.2) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 33.000 | 3.340 |
| High resolution limit [Å] | 3.180 | 3.180 |
| Number of reflections | 11684 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION | 8.5 | 273 | 12% PEG4000, pH 8.5, VAPOR DIFFUSION, temperature 273K |
