4AJ8
Crystallographic structure of thioredoxin from Litopenaeus vannamei (partially reduced).
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | ROTATING ANODE |
Source details | RIGAKU MICROMAX-007 HF |
Temperature [K] | 100 |
Detector technology | IMAGE PLATE |
Collection date | 2011-08-11 |
Detector | RIGAKU R-AXIS IV PLUS PLUS |
Spacegroup name | P 32 1 2 |
Unit cell lengths | 57.523, 57.523, 118.016 |
Unit cell angles | 90.00, 90.00, 120.00 |
Refinement procedure
Resolution | 23.218 - 1.540 |
R-factor | 0.1802 |
Rwork | 0.178 |
R-free | 0.21520 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 3zzx |
RMSD bond length | 0.027 |
RMSD bond angle | 2.353 |
Data reduction software | XDS |
Data scaling software | SCALA |
Phasing software | PHASER |
Refinement software | PHENIX ((PHENIX.REFINE)) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 24.370 | 1.620 |
High resolution limit [Å] | 1.540 | 1.540 |
Rmerge | 0.060 | 0.250 |
Number of reflections | 33397 | |
<I/σ(I)> | 6.6 | 3 |
Completeness [%] | 99.7 | 98.6 |
Redundancy | 6.3 | 5.5 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | 4.6 | 2.0 M AMMONIUM SUPHATE, 0.1 M SODIUM ACETATE, PH 4.6 |