3NEX
V30M mutant human transthyretin (TTR) complexed with GC-24 (V30M:GC-24)
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | LNLS BEAMLINE W01B-MX2 |
Synchrotron site | LNLS |
Beamline | W01B-MX2 |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2009-03-15 |
Detector | MARMOSAIC 225 mm CCD |
Wavelength(s) | 1.43016 |
Spacegroup name | P 21 21 2 |
Unit cell lengths | 43.760, 85.400, 64.320 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 22.150 - 1.700 |
R-factor | 0.164 |
Rwork | 0.162 |
R-free | 0.20700 |
Structure solution method | MOLECULAR REPLACEMENT |
RMSD bond length | 0.013 |
RMSD bond angle | 1.425 |
Data reduction software | MOSFLM |
Data scaling software | SCALA (3.3.16) |
Phasing software | PHASER |
Refinement software | REFMAC |
Data quality characteristics
Overall | Inner shell | Outer shell | |
Low resolution limit [Å] | 64.320 | 22.150 | 1.740 |
High resolution limit [Å] | 1.650 | 5.220 | 1.650 |
Rmerge | 0.045 | 0.407 | |
Total number of observations | 6678 | 29325 | |
Number of reflections | 29737 | ||
<I/σ(I)> | 14.6 | 10.8 | 1.9 |
Completeness [%] | 99.9 | 97.1 | 100 |
Redundancy | 7 | 6.5 | 6.9 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 7.5 | 293 | 0.2 M CaCl2, 0.1 M HEPES pH 7.5, 28% PEG 400, vapor diffusion, hanging drop, temperature 293K |