3NI6
Crystal structure of the FK506 binding domain of Plasmodium vivax FKBP35
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | NSRRC BEAMLINE BL13B1 |
| Synchrotron site | NSRRC |
| Beamline | BL13B1 |
| Temperature [K] | 100 |
| Detector technology | CCD |
| Collection date | 2009-11-04 |
| Detector | ADSC QUANTUM 315 |
| Wavelength(s) | 1.0 |
| Spacegroup name | P 1 21 1 |
| Unit cell lengths | 54.917, 41.857, 55.339 |
| Unit cell angles | 90.00, 106.40, 90.00 |
Refinement procedure
| Resolution | 22.670 - 1.420 |
| R-factor | 0.17307 |
| Rwork | 0.171 |
| R-free | 0.21872 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 3ihz |
| RMSD bond length | 0.014 |
| RMSD bond angle | 1.519 |
| Data reduction software | HKL-2000 |
| Data scaling software | HKL-2000 |
| Phasing software | PHASES |
| Refinement software | REFMAC (5.5.0072) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 30.000 | 1.470 |
| High resolution limit [Å] | 1.420 | 1.420 |
| Number of reflections | 44603 | |
| Completeness [%] | 97.9 | 88.3 |
| Redundancy | 5.8 | 4.4 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, SITTING DROP | 8.5 | 291 | 30% PEG 4000, 0.1M Tris HCl, 0.2M magnesium chloride, pH 8.5, VAPOR DIFFUSION, SITTING DROP, temperature 291K |
