3Q9C
Crystal Structure of H159A APAH complexed with N8-acetylspermidine
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | APS BEAMLINE 24-ID-C |
Synchrotron site | APS |
Beamline | 24-ID-C |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2010-06-11 |
Detector | ADSC QUANTUM 315r |
Wavelength(s) | 0.97949 |
Spacegroup name | P 1 |
Unit cell lengths | 117.461, 120.154, 118.448 |
Unit cell angles | 98.47, 94.41, 115.89 |
Refinement procedure
Resolution | 50.000 - 2.300 |
R-factor | 0.1859 |
Rwork | 0.186 |
R-free | 0.22710 |
Structure solution method | FOURIER SYNTHESIS |
Starting model (for MR) | 3q9f |
RMSD bond length | 0.007 |
RMSD bond angle | 1.217 |
Data reduction software | HKL-2000 |
Data scaling software | SCALEPACK |
Phasing software | CNS |
Refinement software | CNS |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 50.000 | 2.370 |
High resolution limit [Å] | 2.300 | 2.300 |
Rmerge | 0.109 | 0.361 |
Number of reflections | 219596 | |
<I/σ(I)> | 7.472 | 2.059 |
Completeness [%] | 86.9 | 96.9 |
Redundancy | 2.4 | 2.3 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 6.2 | 298 | 1.0 M sodium phosphate, 0.8 M potassium phosphate, 0.2 M lithium sulfate, 0.1 M CAPS pH 6.2, VAPOR DIFFUSION, HANGING DROP, temperature 298K |