5KM4
Human Histidine Triad Nucleotide Binding Protein 1 (hHint1)-5-Iodo-UMP 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 | 2014-12-08 |
| Detector | DECTRIS PILATUS 6M |
| Wavelength(s) | 1.000 |
| Spacegroup name | C 1 2 1 |
| Unit cell lengths | 78.852, 46.309, 63.817 |
| Unit cell angles | 90.00, 93.98, 90.00 |
Refinement procedure
| Resolution | 32.468 - 1.400 |
| R-factor | 0.1767 |
| Rwork | 0.175 |
| R-free | 0.20040 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 3tw2 |
| RMSD bond length | 0.007 |
| RMSD bond angle | 1.200 |
| Data reduction software | XDS |
| Data scaling software | SCALA |
| Phasing software | PHASER |
| Refinement software | PHENIX |
Data quality characteristics
| Overall | Inner shell | Outer shell | |
| Low resolution limit [Å] | 39.907 | 39.907 | 1.405 |
| High resolution limit [Å] | 1.400 | 6.489 | 1.400 |
| Rmerge | 0.055 | 0.034 | 0.228 |
| Total number of observations | 140360 | 1550 | 1432 |
| Number of reflections | 44339 | ||
| <I/σ(I)> | 12.8 | ||
| Completeness [%] | 97.7 | 96.1 | 99.5 |
| Redundancy | 3.2 | 3.3 | 3.2 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 6.7 | 293 | 100 mM MES, 34-39% PEG 8000, |
