3UNN
Monomeric structure of the human MDC1 FHA domain in complex with an MDC1 phospho-T4 peptide
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | PHOTON FACTORY BEAMLINE AR-NW12A |
| Synchrotron site | Photon Factory |
| Beamline | AR-NW12A |
| Temperature [K] | 100 |
| Detector technology | CCD |
| Collection date | 2010-02-09 |
| Detector | ADSC QUANTUM 210 |
| Wavelength(s) | 0.96396 |
| Spacegroup name | P 31 2 1 |
| Unit cell lengths | 52.935, 52.935, 81.241 |
| Unit cell angles | 90.00, 90.00, 120.00 |
Refinement procedure
| Resolution | 20.000 - 1.700 |
| R-factor | 0.2085 |
| Rwork | 0.207 |
| R-free | 0.23190 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 3umz |
| RMSD bond length | 0.007 |
| RMSD bond angle | 1.192 |
| Data reduction software | DENZO |
| Data scaling software | SCALEPACK |
| Phasing software | PHASER |
| Refinement software | REFMAC (5.5.0109) |
Data quality characteristics
| Overall | Inner shell | Outer shell | |
| Low resolution limit [Å] | 45.000 | 45.000 | 1.730 |
| High resolution limit [Å] | 1.700 | 4.610 | 1.700 |
| Rmerge | 0.046 | 0.025 | 0.425 |
| Number of reflections | 14992 | ||
| <I/σ(I)> | 14.8 | ||
| Completeness [%] | 99.9 | 98.5 | 100 |
| Redundancy | 10.7 | 9.6 | 10.7 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, SITTING DROP | 6.6 | 293 | 0.2M Ammonium acetate, 0.1M HEPES, 57% MPD, pH 6.6, VAPOR DIFFUSION, SITTING DROP, temperature 293K |
