6J53
Crystal structure of human HINT1 complexing with ATP
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | APS BEAMLINE 21-ID-G |
Synchrotron site | APS |
Beamline | 21-ID-G |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2011-07-06 |
Detector | MARMOSAIC 300 mm CCD |
Wavelength(s) | 0.97857 |
Spacegroup name | C 1 2 1 |
Unit cell lengths | 78.586, 46.501, 63.916 |
Unit cell angles | 90.00, 94.39, 90.00 |
Refinement procedure
Resolution | 23.843 - 1.520 |
R-factor | 0.152 |
Rwork | 0.151 |
R-free | 0.16920 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 4eqe |
Data reduction software | HKL-2000 |
Data scaling software | HKL-2000 |
Refinement software | PHENIX (1.13_2998) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 25.000 | 1.550 |
High resolution limit [Å] | 1.520 | 1.520 |
Rmerge | 0.036 | 0.108 |
Number of reflections | 35501 | 1255 |
<I/σ(I)> | 40.5 | |
Completeness [%] | 99.9 | 99.9 |
Redundancy | 3.5 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, SITTING DROP | 7.5 | 291 | HEPES pH 7.5, PEG 3350 |