5KM8
Human Histidine Triad Nucleotide Binding Protein 2 (hHint2) Cidofovir complex
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | APS BEAMLINE 17-ID |
| Synchrotron site | APS |
| Beamline | 17-ID |
| Temperature [K] | 100 |
| Detector technology | PIXEL |
| Collection date | 2013-12-15 |
| Detector | DECTRIS PILATUS 6M |
| Wavelength(s) | 1.000 |
| Spacegroup name | P 21 21 21 |
| Unit cell lengths | 37.990, 73.852, 77.464 |
| Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
| Resolution | 36.926 - 2.000 |
| R-factor | 0.1631 |
| Rwork | 0.161 |
| R-free | 0.21250 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 4inc |
| RMSD bond length | 0.008 |
| RMSD bond angle | 1.171 |
| Data reduction software | XDS |
| Data scaling software | SCALA |
| Phasing software | PHASER |
| Refinement software | PHENIX (1.8.4_1496) |
Data quality characteristics
| Overall | Inner shell | Outer shell | |
| Low resolution limit [Å] | 77.464 | 77.464 | 2.007 |
| High resolution limit [Å] | 2.000 | 9.278 | 2.000 |
| Rmerge | 0.067 | 0.031 | 0.401 |
| Rmeas | 0.073 | ||
| Rpim | 0.029 | ||
| Total number of observations | 94866 | ||
| Number of reflections | 15330 | ||
| <I/σ(I)> | 19.1 | ||
| Completeness [%] | 100.0 | 100 | 100 |
| Redundancy | 6.2 | 5 | 6.2 |
| CC(1/2) | 0.999 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 6.5 | 293 | 100 mM MES, 45% PEG 8000 |
