3HZF
Structure of TR-alfa bound to selective thyromimetic GC-1 in C2 space group
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | ROTATING ANODE |
| Source details | RIGAKU ULTRAX 18 |
| Temperature [K] | 100 |
| Detector technology | IMAGE PLATE |
| Collection date | 2003-11-25 |
| Detector | MAR scanner 345 mm plate |
| Wavelength(s) | 1.5418 |
| Spacegroup name | C 1 2 1 |
| Unit cell lengths | 89.799, 78.777, 43.071 |
| Unit cell angles | 90.00, 95.17, 90.00 |
Refinement procedure
| Resolution | 44.720 - 2.500 |
| R-factor | 0.19188 |
| Rwork | 0.188 |
| R-free | 0.26293 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 1bsx |
| RMSD bond length | 0.018 |
| RMSD bond angle | 1.813 |
| Data reduction software | MOSFLM |
| Data scaling software | SCALA |
| Phasing software | AMoRE |
| Refinement software | REFMAC (5.1.24) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 44.720 | 2.640 |
| High resolution limit [Å] | 2.500 | 2.500 |
| Rmerge | 0.076 | 0.366 |
| Number of reflections | 9092 | |
| <I/σ(I)> | 7.8 | 2.1 |
| Completeness [%] | 91.6 | 83.7 |
| Redundancy | 7.2 | 7.2 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 7.2 | 291 | 1.2M sodium acetate, 100mM sodium cacodylate, pH 7.2, VAPOR DIFFUSION, HANGING DROP, temperature 291K |
