5THT
Crystal Structure of G303A HDAC8 in complex with M344
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | APS BEAMLINE 24-ID-E |
| Synchrotron site | APS |
| Beamline | 24-ID-E |
| Temperature [K] | 100 |
| Detector technology | CCD |
| Collection date | 2015-11-09 |
| Detector | ADSC QUANTUM 315 |
| Wavelength(s) | 0.97923 |
| Spacegroup name | P 1 21 1 |
| Unit cell lengths | 97.700, 83.810, 99.780 |
| Unit cell angles | 90.00, 91.72, 90.00 |
Refinement procedure
| Resolution | 97.656 - 2.407 |
| R-factor | 0.1817 |
| Rwork | 0.180 |
| R-free | 0.21230 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 3ewf |
| RMSD bond length | 0.002 |
| RMSD bond angle | 0.465 |
| Data reduction software | iMOSFLM |
| Data scaling software | Aimless |
| Phasing software | PHASER |
| Refinement software | PHENIX ((1.10.1_2155: ???)) |
Data quality characteristics
| Overall | |
| Low resolution limit [Å] | 97.660 |
| High resolution limit [Å] | 2.407 |
| Rmerge | 0.068 |
| Number of reflections | 62588 |
| <I/σ(I)> | 12.5 |
| Completeness [%] | 99.9 |
| Redundancy | 3.5 |
| CC(1/2) | 0.996 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, SITTING DROP | 294 | 100 mM HEPES (pH 7.5), 22% w/v PEG 6000, 4 mM TCEP |
