2YEL
Crystal Structure of the First Bromodomain of Human Brd4 with the inhibitor GW841819X
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | ESRF |
| Synchrotron site | ESRF |
| Temperature [K] | 100 |
| Collection date | 2009-03-17 |
| Spacegroup name | P 21 21 21 |
| Unit cell lengths | 37.083, 44.308, 78.679 |
| Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
| Resolution | 44.320 - 1.650 |
| R-factor | 0.16757 |
| Rwork | 0.165 |
| R-free | 0.21119 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 2oss |
| RMSD bond length | 0.008 |
| RMSD bond angle | 1.244 |
| Phasing software | PHASER |
| Refinement software | REFMAC (5.5.0102) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 44.310 | 1.710 |
| High resolution limit [Å] | 1.650 | 1.620 |
| Rmerge | 0.090 | 0.390 |
| Number of reflections | 16241 | |
| <I/σ(I)> | 9.5 | 3.7 |
| Completeness [%] | 100.0 | 100 |
| Redundancy | 6.85 | 6.9 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | 5.5 | 17.5% PEG 3350, 0.2 M (NH4)2SO4, 0.1 M BIS TRIS PH 5.5. |
