5TZL
Structure of transthyretin in complex with the kinetic stabilizer 201
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | SSRL BEAMLINE BL11-1 |
Synchrotron site | SSRL |
Beamline | BL11-1 |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2006-11-17 |
Detector | MARMOSAIC 325 mm CCD |
Wavelength(s) | 0.99184 |
Spacegroup name | P 21 21 2 |
Unit cell lengths | 43.265, 85.467, 64.285 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 33.100 - 1.400 |
R-factor | 0.13429 |
Rwork | 0.133 |
R-free | 0.16721 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 2fbr |
RMSD bond length | 0.019 |
RMSD bond angle | 1.891 |
Data reduction software | DENZO |
Data scaling software | HKL-2000 |
Phasing software | PHASER |
Refinement software | REFMAC (5.7.0029) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 50.000 | 1.450 |
High resolution limit [Å] | 1.400 | 1.400 |
Rmerge | 0.555 | |
Number of reflections | 47590 | |
<I/σ(I)> | 28.7 | 2.4 |
Completeness [%] | 99.7 | 100 |
Redundancy | 4 | 3.9 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, SITTING DROP | 5.5 | 298 | WT-TTR at 4 mg/mL and five-fold molar excess compound 201 crystallized from solution containing 1.395 M sodium citrate, 3.5% v/v glycerol at pH 5.5. Crystals cryoprotected by addition of 10% (v/v) glycerol. |