4PCU
Crystal structure of delta516-525 E201S human cystathionine beta-synthase with AdoMet
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | ALBA BEAMLINE XALOC |
Synchrotron site | ALBA |
Beamline | XALOC |
Temperature [K] | 100 |
Detector technology | PIXEL |
Collection date | 2014-03-05 |
Detector | DECTRIS PILATUS 6M |
Wavelength(s) | 0.9793 |
Spacegroup name | P 31 2 1 |
Unit cell lengths | 141.354, 141.354, 108.528 |
Unit cell angles | 90.00, 90.00, 120.00 |
Refinement procedure
Resolution | 40.805 - 3.578 |
R-factor | 0.2582 |
Rwork | 0.257 |
R-free | 0.27670 |
RMSD bond length | 0.009 |
RMSD bond angle | 1.302 |
Data scaling software | XSCALE |
Refinement software | PHENIX ((phenix.refine: 1.9_1692)) |
Data quality characteristics
Overall | |
Low resolution limit [Å] | 40.805 |
High resolution limit [Å] | 3.578 |
Number of reflections | 14903 |
<I/σ(I)> | 5.01 |
Completeness [%] | 98.6 |
Redundancy | 3.39 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 293 | 20% (vol/vol) polyethylene glycol monomethyl ether 3350 and 0.34mM SAM |