5BUA
Lysine 120-acetylated P53 DNA binding domain in a complex with DNA.
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | ESRF BEAMLINE ID14-2 |
| Synchrotron site | ESRF |
| Beamline | ID14-2 |
| Temperature [K] | 100 |
| Detector technology | CCD |
| Collection date | 2014-02-27 |
| Detector | MARMOSAIC 225 mm CCD |
| Wavelength(s) | 0.932 |
| Spacegroup name | C 1 2 1 |
| Unit cell lengths | 137.252, 48.892, 34.014 |
| Unit cell angles | 90.00, 92.60, 90.00 |
Refinement procedure
| Resolution | 33.979 - 1.812 |
| R-factor | 0.1651 |
| Rwork | 0.162 |
| R-free | 0.21350 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 3kmd |
| RMSD bond length | 0.007 |
| RMSD bond angle | 1.282 |
| Data reduction software | DENZO |
| Data scaling software | SCALEPACK |
| Phasing software | PHASER (2.5.3) |
| Refinement software | PHENIX (1.9_1692) |
Data quality characteristics
| Overall | Inner shell | Outer shell | |
| Low resolution limit [Å] | 50.000 | 50.000 | 1.830 |
| High resolution limit [Å] | 1.800 | 4.880 | 1.800 |
| Rmerge | 0.074 | 0.041 | 0.489 |
| Rmeas | 0.082 | 0.045 | 0.584 |
| Rpim | 0.036 | 0.019 | 0.313 |
| Total number of observations | 92223 | ||
| Number of reflections | 18564 | ||
| <I/σ(I)> | 10.1 | ||
| Completeness [%] | 90.4 | 99.9 | 51.1 |
| Redundancy | 5 | 5.1 | 3 |
| CC(1/2) | 0.998 | 0.817 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, SITTING DROP | 6.1 | 286 | 0.2M Ammonium fluoride; 20% PEG 3350 |
