4L10
Tankyrase 2 in complex with 4'-methoxy flavone
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | ESRF BEAMLINE ID14-4 |
| Synchrotron site | ESRF |
| Beamline | ID14-4 |
| Temperature [K] | 100 |
| Detector technology | CCD |
| Collection date | 2012-09-15 |
| Detector | ADSC QUANTUM 315r |
| Wavelength(s) | 0.93927 |
| Spacegroup name | C 2 2 21 |
| Unit cell lengths | 91.360, 97.810, 118.320 |
| Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
| Resolution | 48.900 - 1.700 |
| R-factor | 0.1756 |
| Rwork | 0.174 |
| R-free | 0.20263 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 3u9h |
| RMSD bond length | 0.010 |
| RMSD bond angle | 1.436 |
| Data reduction software | XDS |
| Data scaling software | XSCALE |
| Phasing software | MOLREP |
| Refinement software | REFMAC (5.7.0029) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 48.900 | 1.750 |
| High resolution limit [Å] | 1.700 | 1.700 |
| Rmerge | 0.063 | 0.822 |
| Number of reflections | 58132 | |
| <I/σ(I)> | 14.63 | 2.17 |
| Completeness [%] | 99.8 | 98 |
| Redundancy | 5.4 | 4.8 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, SITTING DROP | 8.5 | 277 | 0.2 M Li2SO4, 0.1 M Tris HCl 24 % PEG3350, pH 8.5, VAPOR DIFFUSION, SITTING DROP, temperature 277K |
