5KM5
Human Histidine Triad Nucleotide Binding Protein 2 (hHint2) triciribine 5'-monoposphate catalytic product 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 | P 21 21 21 |
| Unit cell lengths | 38.129, 76.045, 77.821 |
| Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
| Resolution | 38.023 - 2.100 |
| R-factor | 0.1739 |
| Rwork | 0.171 |
| R-free | 0.22420 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 4inc |
| RMSD bond length | 0.008 |
| RMSD bond angle | 1.328 |
| 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] | 76.045 | 76.045 | 2.107 |
| High resolution limit [Å] | 2.100 | 9.741 | 2.100 |
| Rmerge | 0.074 | 0.035 | 0.287 |
| Total number of observations | 888 | 858 | |
| Number of reflections | 13736 | ||
| <I/σ(I)> | 15.9 | ||
| Completeness [%] | 99.7 | 100 | 100 |
| Redundancy | 6 | 5.1 | 5.8 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 6.5 | 293 | 100 mM MES, 45% PEG 8000 |
