3V77
Crystal structure of a putative fumarylacetoacetate isomerase/hydrolase from Oleispira antarctica
Replaces: 3L53Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | ROTATING ANODE |
Source details | RIGAKU |
Temperature [K] | 100 |
Detector technology | IMAGE PLATE |
Collection date | 2009-09-22 |
Detector | RIGAKU RAXIS HTC |
Wavelength(s) | 1.54178 |
Spacegroup name | C 2 2 21 |
Unit cell lengths | 158.265, 161.386, 114.836 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 27.510 - 2.100 |
R-factor | 0.20156 |
Rwork | 0.199 |
R-free | 0.25592 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 1gtt |
RMSD bond length | 0.011 |
RMSD bond angle | 1.397 |
Data reduction software | HKL-2000 |
Data scaling software | HKL-2000 |
Phasing software | PHASER |
Refinement software | REFMAC (5.5.0109) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 50.000 | 2.030 |
High resolution limit [Å] | 2.000 | 2.000 |
Number of reflections | 97790 | |
<I/σ(I)> | 20.88 | 1.76 |
Completeness [%] | 98.7 | 83.5 |
Redundancy | 2.5 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 4.6 | 295 | 1.2 M DI-AMMONIUM TARTRATE, 0.1 M SODIUM ACETATE TRIHYDRATE PH 4.6, 10 MM ZINC SULFATE, VAPOR DIFFUSION, HANGING DROP, temperature 295K |