5F3K
X-Ray Crystallographic Structure of hTrap1 N-terminal Domain-apo
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | APS BEAMLINE 19-ID |
Synchrotron site | APS |
Beamline | 19-ID |
Temperature [K] | 93 |
Detector technology | CCD |
Collection date | 2013-02-17 |
Detector | ADSC QUANTUM 315r |
Wavelength(s) | 0.97918 |
Spacegroup name | P 32 2 1 |
Unit cell lengths | 65.250, 65.250, 233.372 |
Unit cell angles | 90.00, 90.00, 120.00 |
Refinement procedure
Resolution | 77.790 - 1.820 |
R-factor | 0.18332 |
Rwork | 0.182 |
R-free | 0.21450 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 5f5r |
RMSD bond length | 0.007 |
RMSD bond angle | 0.835 |
Data reduction software | HKL-3000 |
Data scaling software | HKL-3000 |
Phasing software | MOLREP |
Refinement software | REFMAC (5.5.0072) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 77.790 | 1.850 |
High resolution limit [Å] | 1.820 | 1.820 |
Rmerge | 0.486 | |
Number of reflections | 52606 | |
<I/σ(I)> | 14 | 3.75 |
Completeness [%] | 99.4 | 99.6 |
Redundancy | 6.7 | 7 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 7.5 | 289 | 2 micro liter hTRAP1N, 25 mg/ml, in 30 mM TrisHCl pH 8.5, 0.15 M NaCl, and 1 mM TCEP was mixed with an equal volume of reservoir solution consisting of 100 mM HEPES pH 7.5, 100 mM CaCl2 , 23 percent PEG3350, 4 percent isopropanol, and 0.4 micro liter of 1 M LiCl2. |