4AC2
CRYSTAL STRUCTURE OF TRANSTHYRETIN IN COMPLEX WITH LIGAND C-7
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | ROTATING ANODE |
Source details | RIGAKU RU300 |
Temperature [K] | 120 |
Detector technology | IMAGE PLATE |
Collection date | 2009-12-30 |
Detector | MARRESEARCH |
Spacegroup name | P 21 21 2 |
Unit cell lengths | 85.500, 42.500, 64.510 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 64.510 - 1.810 |
R-factor | 0.19255 |
Rwork | 0.188 |
R-free | 0.23560 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 1dvq |
RMSD bond length | 0.023 |
RMSD bond angle | 2.055 |
Data reduction software | MOSFLM |
Data scaling software | SCALA |
Phasing software | MOLREP |
Refinement software | REFMAC (5.5.0109) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 42.800 | 5.700 |
High resolution limit [Å] | 1.800 | 1.800 |
Rmerge | 0.080 | 0.340 |
Number of reflections | 22391 | |
<I/σ(I)> | 17.8 | 5.6 |
Completeness [%] | 99.5 | 96.5 |
Redundancy | 8.5 | 8.1 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 7.4 | 298 | POTASSIUM CHLORIDE, POTASSIUM PHOSPHATE, AMMONIUM SULFATE, PH 7.4, VAPOR DIFFUSION, HANGING DROP, TEMPERATURE 298K |