1XON
Catalytic Domain Of Human Phosphodiesterase 4D In Complex With Piclamilast
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | ALS BEAMLINE 8.3.1 |
Synchrotron site | ALS |
Beamline | 8.3.1 |
Temperature [K] | 93 |
Detector technology | CCD |
Collection date | 2003-11-13 |
Detector | ADSC QUANTUM 210 |
Wavelength(s) | 1.1 |
Spacegroup name | P 21 21 21 |
Unit cell lengths | 60.196, 78.877, 164.312 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 81.650 - 1.720 |
R-factor | 0.17487 |
Rwork | 0.174 |
R-free | 0.19924 |
Structure solution method | MOLECULAR REPLACEMENT |
RMSD bond length | 0.007 |
RMSD bond angle | 1.128 |
Data scaling software | ELVES |
Phasing software | EPMR |
Refinement software | REFMAC (5.1.25) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 81.650 | 1.765 |
High resolution limit [Å] | 1.720 | 1.720 |
Rmerge | 0.087 | 0.782 |
Number of reflections | 76851 | |
<I/σ(I)> | 7 | 1.6 |
Completeness [%] | 96.5 | 99.6 |
Redundancy | 3.7 | 3.6 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, SITTING DROP | 7 | 288 | PEG3350, ethylene glycol, isopropanol, glycerol and DTT, pH 7.0, VAPOR DIFFUSION, SITTING DROP, temperature 288K |