6MBK
SETD3, a Histidine Methyltransferase, in Complex with an Actin Peptide and SAH, First P212121 Crystal Form
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | APS BEAMLINE 22-ID |
Synchrotron site | APS |
Beamline | 22-ID |
Temperature [K] | 100 |
Detector technology | PIXEL |
Collection date | 2018-03-26 |
Detector | DECTRIS EIGER X 16M |
Wavelength(s) | 1.0000 |
Spacegroup name | P 21 21 21 |
Unit cell lengths | 60.279, 115.970, 173.589 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 37.732 - 1.690 |
R-factor | 0.2278 |
Rwork | 0.228 |
R-free | 0.24310 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 3smt |
RMSD bond length | 0.010 |
RMSD bond angle | 0.942 |
Data reduction software | HKL-2000 |
Data scaling software | HKL-2000 |
Phasing software | PHENIX |
Refinement software | PHENIX ((1.13_2998)) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 39.380 | 1.750 |
High resolution limit [Å] | 1.690 | 1.690 |
Rpim | 0.061 | 0.592 |
Number of reflections | 135382 | 13262 |
<I/σ(I)> | 11.3 | 1.7 |
Completeness [%] | 99.2 | 98.4 |
Redundancy | 19.2 | 8.9 |
CC(1/2) | 0.720 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 5.5 | 292 | 0.2 M Ammonium sulfate, 0.1 M BIS-TRIS pH 5.5, 25% w/v Polyethylene glycol 3,350 |