5OAZ
Crystal structure of the Abl-SH3 domain at pH 7.5
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | ALBA BEAMLINE XALOC |
| Synchrotron site | ALBA |
| Beamline | XALOC |
| Temperature [K] | 100 |
| Detector technology | PIXEL |
| Collection date | 2015-10-24 |
| Detector | DECTRIS PILATUS 6M |
| Wavelength(s) | 0.97949 |
| Spacegroup name | P 32 |
| Unit cell lengths | 49.919, 49.919, 45.046 |
| Unit cell angles | 90.00, 90.00, 120.00 |
Refinement procedure
| Resolution | 20.000 - 1.030 |
| R-factor | 0.1455 |
| Rwork | 0.145 |
| R-free | 0.16280 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 4jjb |
| RMSD bond length | 0.010 |
| RMSD bond angle | 1.114 |
| Data reduction software | XDS |
| Data scaling software | Aimless (0.5.17) |
| Phasing software | PHASER |
| Refinement software | PHENIX |
Data quality characteristics
| Overall | Inner shell | Outer shell | |
| Low resolution limit [Å] | 20.000 | 19.970 | 1.050 |
| High resolution limit [Å] | 1.030 | 5.640 | 1.030 |
| Rmerge | 0.036 | 0.037 | 0.592 |
| Rmeas | 0.040 | 0.043 | 0.726 |
| Rpim | 0.019 | 0.022 | 0.409 |
| Number of reflections | 118361 | ||
| <I/σ(I)> | 29.7 | ||
| Completeness [%] | 95.3 | 96.3 | 89.5 |
| Redundancy | 4.9 | 4.3 | 2.6 |
| CC(1/2) | 0.998 | 0.991 | 0.691 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 7.5 | 298 | 1.65 M Ammonium sulphate, 0.1 M Hepes and 6% PEG 300 |
