4ZRS
Crystal structure of a cloned feruloyl esterase from a soil metagenomic library
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | ROTATING ANODE |
Source details | OTHER |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2014-05-09 |
Detector | OXFORD ONYX CCD |
Wavelength(s) | 1.54056 |
Spacegroup name | P 1 21 1 |
Unit cell lengths | 52.156, 101.790, 69.822 |
Unit cell angles | 90.00, 110.62, 90.00 |
Refinement procedure
Resolution | 65.350 - 2.000 |
R-factor | 0.15247 |
Rwork | 0.150 |
R-free | 0.19930 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 4nsp |
RMSD bond length | 0.018 |
RMSD bond angle | 1.740 |
Data reduction software | CrysalisPro |
Data scaling software | SCALA |
Phasing software | PHASER |
Refinement software | REFMAC (5.8.0049) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 65.350 | 2.110 |
High resolution limit [Å] | 2.000 | 2.000 |
Rmerge | 0.104 | 0.435 |
Number of reflections | 45906 | |
<I/σ(I)> | 10.6 | 3 |
Completeness [%] | 99.7 | 100 |
Redundancy | 3.3 | 3.2 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, SITTING DROP | 7.5 | 298 | 1.2 M ammonium sulfate, 100 mM HEPES |