5AYF
Crystal structure of SET7/9 in complex with cyproheptadine
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 | 2010-10-16 |
Detector | ADSC QUANTUM 210 |
Wavelength(s) | 1.000 |
Spacegroup name | P 21 21 2 |
Unit cell lengths | 102.463, 39.366, 67.275 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 25.616 - 2.005 |
R-factor | 0.1973 |
Rwork | 0.194 |
R-free | 0.25810 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 1n6a |
RMSD bond length | 0.008 |
RMSD bond angle | 1.085 |
Phasing software | PHASER |
Refinement software | PHENIX ((phenix.refine: 1.7.3_928)) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 50.000 | 2.070 |
High resolution limit [Å] | 2.000 | 2.000 |
Rmerge | 0.487 | |
Number of reflections | 18892 | |
<I/σ(I)> | 17.6 | 4.2 |
Completeness [%] | 99.9 | 100 |
Redundancy | 7.2 | 7.3 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 8.5 | 277 | 0.1M Tris-HCl pH 8.5, 31% PEG 6000 |