7SS8
Human P300 complexed with a proline-based inhibitor
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | APS BEAMLINE 22-ID |
| Synchrotron site | APS |
| Beamline | 22-ID |
| Temperature [K] | 93 |
| Detector technology | PIXEL |
| Collection date | 2018-06-06 |
| Detector | DECTRIS EIGER X 16M |
| Wavelength(s) | 1 |
| Spacegroup name | P 1 21 1 |
| Unit cell lengths | 63.855, 49.503, 110.602 |
| Unit cell angles | 90.00, 102.27, 90.00 |
Refinement procedure
| Resolution | 38.810 - 2.150 |
| R-factor | 0.2011 |
| Rwork | 0.200 |
| R-free | 0.22970 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 4bhw |
| RMSD bond length | 0.009 |
| RMSD bond angle | 1.439 |
| Data reduction software | HKL-2000 |
| Data scaling software | SCALEPACK |
| Phasing software | MOLREP |
| Refinement software | REFMAC (5.8.0267) |
Data quality characteristics
| Overall | Inner shell | Outer shell | |
| Low resolution limit [Å] | 50.000 | 50.000 | 2.090 |
| High resolution limit [Å] | 2.050 | 5.560 | 2.050 |
| Rmerge | 0.066 | 0.021 | 0.668 |
| Rmeas | 0.080 | 0.025 | 0.842 |
| Rpim | 0.044 | 0.014 | 0.504 |
| Total number of observations | 124653 | ||
| Number of reflections | 41313 | 2155 | 1864 |
| <I/σ(I)> | 10.7 | ||
| Completeness [%] | 96.2 | 95.5 | 87.5 |
| Redundancy | 3 | 3.2 | 2.2 |
| CC(1/2) | 0.987 | 0.533 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION | 6.5 | 277 | 20% PEG3350, 0.1 M MES pH 6.5 |
