1VA4
Pseudomonas fluorescens aryl esterase
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | ROTATING ANODE |
| Source details | RIGAKU MICROMAX-007 |
| Temperature [K] | 93 |
| Detector technology | IMAGE PLATE |
| Collection date | 2003-04-15 |
| Detector | RIGAKU RAXIS HTC |
| Wavelength(s) | 1.5418 |
| Spacegroup name | P 32 |
| Unit cell lengths | 146.040, 146.040, 129.880 |
| Unit cell angles | 90.00, 90.00, 120.00 |
Refinement procedure
| Resolution | 48.530 - 1.804 |
| Rwork | 0.175 |
| R-free | 0.20200 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 1a8s |
| RMSD bond length | 0.023 |
| RMSD bond angle | 1.590 |
| Data reduction software | CrystalClear ((MSC/RIGAKU)) |
| Data scaling software | d*TREK |
| Phasing software | MOLREP |
| Refinement software | REFMAC (5.1.24) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 48.800 | 1.851 |
| High resolution limit [Å] | 1.800 | 1.804 |
| Number of reflections | 271452 | |
| <I/σ(I)> | 14 | 3.7 |
| Completeness [%] | 95.2 | 65.8 |
| Redundancy | 5.04 | 2.43 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 7.5 | 293 | 1% PEG 400, 1.65M (NH4)2SO4, 0.1M HEPES , pH 7.5, VAPOR DIFFUSION, HANGING DROP, temperature 293K |
