3TNV
Acylphosphatase with thermophilic surface and mesophilic core
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | ROTATING ANODE |
| Source details | RIGAKU MICROMAX-007 |
| Temperature [K] | 100 |
| Detector technology | IMAGE PLATE |
| Collection date | 2009-05-11 |
| Detector | RIGAKU RAXIS IV++ |
| Wavelength(s) | 1.54 |
| Spacegroup name | P 1 21 1 |
| Unit cell lengths | 28.087, 44.438, 30.813 |
| Unit cell angles | 90.00, 100.99, 90.00 |
Refinement procedure
| Resolution | 15.858 - 1.600 |
| R-factor | 0.1485 |
| Rwork | 0.146 |
| R-free | 0.16700 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 1w2i |
| RMSD bond length | 0.006 |
| RMSD bond angle | 0.950 |
| Data reduction software | MOSFLM |
| Data scaling software | SCALA |
| Phasing software | PHENIX |
| Refinement software | PHENIX ((phenix.refine)) |
Data quality characteristics
| Overall | Inner shell | Outer shell | |
| Low resolution limit [Å] | 15.860 | 5.060 | 1.690 |
| High resolution limit [Å] | 1.600 | 3.580 | 1.600 |
| Number of reflections | 9923 | ||
| Completeness [%] | 99.9 | 97 | 100 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, SITTING DROP | 8.3 | 289 | 0.2M Sodium citrate tribasic dehydrate, 20% w/v PEG 3350 , pH 8.3, VAPOR DIFFUSION, SITTING DROP, temperature 289K |
