4TOT
Crystal structure of rat cyclophilin D in complex with a potent nonimmunosuppressive inhibitor
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | ROTATING ANODE |
| Source details | RIGAKU FR-E+ SUPERBRIGHT |
| Temperature [K] | 100 |
| Detector technology | CCD |
| Collection date | 2012-09-28 |
| Detector | Bruker Platinum 135 |
| Wavelength(s) | 1.5418 |
| Spacegroup name | P 1 |
| Unit cell lengths | 50.197, 57.286, 75.274 |
| Unit cell angles | 89.95, 83.81, 89.86 |
Refinement procedure
| Resolution | 30.300 - 2.390 |
| R-factor | 0.1978 |
| Rwork | 0.196 |
| R-free | 0.22980 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | in-house structure |
| RMSD bond length | 0.009 |
| RMSD bond angle | 1.100 |
| Refinement software | BUSTER (2.11.4) |
Data quality characteristics
| Overall | |
| Low resolution limit [Å] | 45.470 |
| High resolution limit [Å] | 2.390 |
| Number of reflections | 30008 |
| <I/σ(I)> | 7.82 |
| Completeness [%] | 90.9 |
| Redundancy | 3.22 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 6.5 | 291.15 | 100 mM MES pH 6.5, 5% (v/v) PEG 400, 2M ammonium sulfate |
