2P0K
Crystal structure of SCMH1
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | APS BEAMLINE 17-ID |
Synchrotron site | APS |
Beamline | 17-ID |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2006-12-04 |
Detector | ADSC QUANTUM 315 |
Wavelength(s) | 1.00000 |
Spacegroup name | P 63 |
Unit cell lengths | 95.735, 95.735, 43.602 |
Unit cell angles | 90.00, 90.00, 120.00 |
Refinement procedure
Resolution | 83.050 - 1.750 |
R-factor | 0.17065 |
Rwork | 0.169 |
R-free | 0.20351 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 2biv |
RMSD bond length | 0.014 |
RMSD bond angle | 1.396 |
Data reduction software | HKL-2000 |
Data scaling software | HKL-2000 |
Phasing software | MOLREP |
Refinement software | REFMAC (5.2.0019) |
Data quality characteristics
Overall | |
Low resolution limit [Å] | 83.050 |
High resolution limit [Å] | 1.750 |
Rmerge | 0.052 |
Number of reflections | 23100 |
<I/σ(I)> | 13.5 |
Completeness [%] | 99.3 |
Redundancy | 4.8 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, SITTING DROP | 7 | 300 | 20% PEG3350, 0.2M Ammonium Citrate, pH 7.0, VAPOR DIFFUSION, SITTING DROP, temperature 300K |