2H77
Crystal structure of human TR alpha bound T3 in monoclinic space group
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | ROTATING ANODE |
Source details | RIGAKU |
Temperature [K] | 100 |
Detector technology | IMAGE PLATE |
Collection date | 2004-01-01 |
Detector | MAR scanner 345 mm plate |
Wavelength(s) | 1.54 |
Spacegroup name | C 1 2 1 |
Unit cell lengths | 117.569, 80.626, 62.614 |
Unit cell angles | 90.00, 121.09, 90.00 |
Refinement procedure
Resolution | 32.220 - 2.330 |
R-factor | 0.19 |
Rwork | 0.187 |
R-free | 0.23800 |
Structure solution method | MOLECULAR REPLACEMENT |
RMSD bond length | 0.027 |
RMSD bond angle | 2.617 |
Data scaling software | SCALA |
Phasing software | MOLREP |
Refinement software | REFMAC (5.2.0005) |
Data quality characteristics
Overall | Inner shell | Outer shell | |
Low resolution limit [Å] | 62.994 | 35.540 | 2.460 |
High resolution limit [Å] | 2.330 | 7.370 | 2.330 |
Rmerge | 0.086 | 0.048 | 0.383 |
Total number of observations | 1068 | 4767 | |
Number of reflections | 18468 | ||
<I/σ(I)> | 7.7 | 10.1 | 2 |
Completeness [%] | 86.0 | 71.9 | 90 |
Redundancy | 1.8 | 2.1 | 1.7 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 7.2 | 298 | 1.0 M sodium cacodylate and 0.1M sodium acetate threehydrate, pH 7.2, VAPOR DIFFUSION, HANGING DROP, temperature 298K |