5NP5
Abl2 SH3 pTyr116/161
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | PETRA III, EMBL c/o DESY BEAMLINE P13 (MX1) |
| Synchrotron site | PETRA III, EMBL c/o DESY |
| Beamline | P13 (MX1) |
| Temperature [K] | 100 |
| Detector technology | PIXEL |
| Collection date | 2015-11-07 |
| Detector | DECTRIS PILATUS 6M-F |
| Wavelength(s) | 0.9763 |
| Spacegroup name | P 1 21 1 |
| Unit cell lengths | 22.510, 45.910, 45.770 |
| Unit cell angles | 90.00, 89.74, 90.00 |
Refinement procedure
| Resolution | 32.413 - 1.400 |
| R-factor | 0.1733 |
| Rwork | 0.172 |
| R-free | 0.19850 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 1abo |
| RMSD bond length | 0.016 |
| RMSD bond angle | 1.610 |
| Data reduction software | XDS |
| Data scaling software | XDS |
| Phasing software | PHASER |
| Refinement software | PHENIX (dev_1750) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 32.413 | 1.440 |
| High resolution limit [Å] | 1.400 | 1.400 |
| Rmerge | 0.031 | 0.550 |
| Number of reflections | 18354 | |
| <I/σ(I)> | 18.34 | 1.93 |
| Completeness [%] | 99.4 | 99 |
| Redundancy | 3.35 | 3.1 |
| CC(1/2) | 1.000 | 0.686 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 4.6 | 293 | 1.8 M (NH4)2SO4, 0.1 M sodium acetate |
