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 | 2000-06-07 |
Detector | MARRESEARCH |
Wavelength(s) | 1.0 |
Spacegroup name | P 21 21 21 |
Unit cell lengths | 50.951, 71.525, 106.000 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 16.940 - 2.100 |
R-factor | 0.201 |
Rwork | 0.200 |
R-free | 0.22580 |
Structure solution method | FOURIER SYNTHESIS |
Starting model (for MR) | 1pmn |
RMSD bond length | 0.010 |
RMSD bond angle | 0.990 |
Data reduction software | HKL-2000 |
Data scaling software | SCALEPACK |
Phasing software | CNX |
Refinement software | BUSTER (2.11.6) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 17.000 | 2.300 |
High resolution limit [Å] | 2.200 | 2.200 |
Number of reflections | 19586 | |
<I/σ(I)> | 10 | 3 |
Completeness [%] | 95.6 | 80.1 |
Redundancy | 7.8 | 7.6 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 7 | 293 | PEG MME 550, ETHYLENE GLYCOL, HEPES |