6L2B
Crystal structure of cyclophilin mutant I164M from Leishmania donovani at 2.65 angstrom resolution
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | ROTATING ANODE |
| Source details | RIGAKU RUH3R |
| Temperature [K] | 295 |
| Detector technology | IMAGE PLATE |
| Collection date | 2019-04-30 |
| Detector | RIGAKU RAXIS IV++ |
| Wavelength(s) | 1.5406 |
| Spacegroup name | P 43 21 2 |
| Unit cell lengths | 48.618, 48.618, 141.322 |
| Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
| Resolution | 45.970 - 2.650 |
| Rwork | 0.177 |
| R-free | 0.22300 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 2haq |
| RMSD bond length | 0.002 |
| RMSD bond angle | 0.510 |
| Data reduction software | CrystalClear (2.0) |
| Data scaling software | CrystalClear (2.0) |
| Phasing software | CrystalClear (2.0) |
| Refinement software | PHENIX (1.14_3260) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 45.970 | 2.746 |
| High resolution limit [Å] | 2.650 | 2.651 |
| Rmerge | 0.102 | 0.102 |
| Rmeas | 0.112 | |
| Number of reflections | 5381 | 5384 |
| <I/σ(I)> | 10.3 | |
| Completeness [%] | 99.8 | 99.9 |
| Redundancy | 5.58 | 5.58 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 8.5 | 295 | 20mM Tris HCl, 100mM NaCl, 0.02% sodium azide, PEG 3350 (Reservoir 30% and precipitant 3% in the final drop), protein at concentration 5 mg/ml. |
