4UDA
MR in complex with dexamethasone
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | ROTATING ANODE |
| Source details | RIGAKU FR-E |
| Temperature [K] | 100 |
| Collection date | 2011-11-04 |
| Detector | RIGAKU R-AXIS HTC |
| Spacegroup name | P 21 21 21 |
| Unit cell lengths | 73.000, 81.400, 45.230 |
| Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
| Resolution | 40.700 - 2.030 |
| R-factor | 0.1872 |
| Rwork | 0.185 |
| R-free | 0.24010 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 2aa2 |
| RMSD bond length | 0.010 |
| RMSD bond angle | 1.010 |
| Data reduction software | XDS |
| Data scaling software | SCALA |
| Phasing software | PHASER |
| Refinement software | BUSTER (2.11.5) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 40.700 | 2.080 |
| High resolution limit [Å] | 2.030 | 2.030 |
| Rmerge | 0.060 | 0.500 |
| Number of reflections | 15085 | |
| <I/σ(I)> | 13.9 | 2.3 |
| Completeness [%] | 83.9 | 83.7 |
| Redundancy | 3.3 | 2.5 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | 7.5 | 30% PEG4000, 0.1M NACL, 0.2M PIPES PH 7.5 |
