4U2D
Crystal structure of dienelactone hydrolase S-2 variant (Q35H, F38L, Q110L, C123S, Y137C, Y145C, N154D, E199G, S208G and G211D) at 1.67 A resolution
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | ROTATING ANODE |
Source details | OTHER |
Temperature [K] | 100 |
Detector technology | IMAGE PLATE |
Collection date | 2013-07-17 |
Detector | MAR scanner 345 mm plate |
Wavelength(s) | 1.5418 |
Spacegroup name | P 21 21 21 |
Unit cell lengths | 48.872, 70.166, 74.150 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 74.150 - 1.670 |
R-factor | 0.17266 |
Rwork | 0.172 |
R-free | 0.19024 |
RMSD bond length | 0.013 |
RMSD bond angle | 1.505 |
Data scaling software | HKL-2000 |
Refinement software | REFMAC (5.6.0117) |
Data quality characteristics
Overall | |
Low resolution limit [Å] | 74.150 |
High resolution limit [Å] | 1.670 |
Number of reflections | 30071 |
<I/σ(I)> | 24.5 |
Completeness [%] | 99.1 |
Redundancy | 6 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 277 | sodium citrate, ammonium sulphate |