7XOZ
Crystal structure of RPPT-TIR
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | NFPSS BEAMLINE BL19U1 |
| Synchrotron site | NFPSS |
| Beamline | BL19U1 |
| Temperature [K] | 100 |
| Detector technology | PIXEL |
| Collection date | 2022-04-30 |
| Detector | DECTRIS EIGER X 16M |
| Wavelength(s) | 0.987 |
| Spacegroup name | P 1 21 1 |
| Unit cell lengths | 69.799, 81.133, 70.713 |
| Unit cell angles | 90.00, 112.33, 90.00 |
Refinement procedure
| Resolution | 39.120 - 2.520 |
| R-factor | 0.2595 |
| Rwork | 0.258 |
| R-free | 0.29750 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 7crc |
| RMSD bond length | 0.009 |
| RMSD bond angle | 0.920 |
| Data reduction software | HKL-2000 |
| Data scaling software | HKL-2000 |
| Phasing software | PHENIX |
| Refinement software | PHENIX (1.20_4478) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 39.120 | 2.610 |
| High resolution limit [Å] | 2.520 | 2.520 |
| Rmeas | 0.293 | |
| Rpim | 0.142 | |
| Number of reflections | 24611 | 2370 |
| <I/σ(I)> | 4 | |
| Completeness [%] | 98.4 | 90.8 |
| Redundancy | 4.3 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION | 277.15 | 20 % w/v polyethylene glycol 3000 (PEG3000), 100 mM HEPES pH 7.5, 200 mM sodium |
