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 |