3PA7
Crystal structure of FKBP from plasmodium vivax in complex with tetrapeptide ALPF
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | ROTATING ANODE |
| Source details | RIGAKU MICROMAX-007 HF |
| Temperature [K] | 113 |
| Detector technology | IMAGE PLATE |
| Collection date | 2010-07-30 |
| Detector | RIGAKU RAXIS IV++ |
| Wavelength(s) | 1.54178 |
| Spacegroup name | C 1 2 1 |
| Unit cell lengths | 88.963, 41.378, 61.303 |
| Unit cell angles | 90.00, 95.02, 90.00 |
Refinement procedure
| Resolution | 24.120 - 2.610 |
| R-factor | 0.2417 |
| Rwork | 0.237 |
| R-free | 0.28700 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 3ihz |
| RMSD bond length | 0.010 |
| RMSD bond angle | 1.338 |
| Data reduction software | HKL-2000 |
| Data scaling software | HKL-2000 |
| Phasing software | PHASER |
| Refinement software | REFMAC (5.5.0072) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 30.000 | 2.740 |
| High resolution limit [Å] | 2.610 | 2.610 |
| Rmerge | 0.028 | 0.028 |
| Number of reflections | 6670 | |
| <I/σ(I)> | 22.03 | 22.03 |
| Completeness [%] | 96.8 | 89.9 |
| Redundancy | 2.7 | 2.7 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, SITTING DROP | 9 | 291 | 100mM BICINE, 2.4M Ammonium sulfate, pH 9.0, VAPOR DIFFUSION, SITTING DROP, temperature 291K |
