5F5R
TRAP1N-ADPNP
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) | 0.97926 |
Spacegroup name | C 2 2 21 |
Unit cell lengths | 92.570, 143.168, 103.011 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 29.410 - 1.850 |
R-factor | 0.1771 |
Rwork | 0.176 |
R-free | 0.20300 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 2cg9 |
RMSD bond length | 0.003 |
RMSD bond angle | 0.656 |
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] | 29.410 | 1.880 |
High resolution limit [Å] | 1.850 | 1.850 |
Rmerge | 0.055 | 0.527 |
Number of reflections | 54569 | |
<I/σ(I)> | 14.9 | 8.4 |
Completeness [%] | 98.5 | 98 |
Redundancy | 7.9 | 7.9 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 287 | 100 mM sodium citrate pH 5.6, 22% PEG4000, 5% isopropanol |