7OE4
C-TERMINAL BROMODOMAIN OF HUMAN BRD2 WITH N-methyl-4-propionyl-1H-pyrrole-2-carboxamide
This is a non-PDB format compatible entry.
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | ROTATING ANODE |
| Source details | RIGAKU FR-E+ SUPERBRIGHT |
| Temperature [K] | 100 |
| Detector technology | CCD |
| Collection date | 2015-01-14 |
| Detector | RIGAKU SATURN A200 |
| Wavelength(s) | 1.54178 |
| Spacegroup name | P 21 21 2 |
| Unit cell lengths | 71.325, 52.773, 31.845 |
| Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
| Resolution | 42.420 - 1.653 |
| Rwork | 0.157 |
| R-free | 0.18470 |
| Structure solution method | FOURIER SYNTHESIS |
| Starting model (for MR) | In house |
| RMSD bond length | 0.003 |
| RMSD bond angle | 1.150 |
| Data reduction software | autoPROC |
| Data scaling software | Aimless |
| Refinement software | REFMAC (5.8.0267) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 42.420 | 1.740 |
| High resolution limit [Å] | 1.650 | 1.650 |
| Number of reflections | 14271 | 1789 |
| <I/σ(I)> | 31.3 | 5.8 |
| Completeness [%] | 95.9 | 85.2 |
| Redundancy | 3 | 2.5 |
| CC(1/2) | 0.999 | 0.821 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION | 298 | 30% PEG 300, 0.1M MES buffer pH6.5 |
