Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | NSLS BEAMLINE X12C |
Synchrotron site | NSLS |
Beamline | X12C |
Temperature [K] | 100 |
Detector technology | IMAGE PLATE |
Collection date | 1996-01-11 |
Detector | MAR scanner 345 mm plate |
Wavelength(s) | 1.0 |
Spacegroup name | P 21 21 21 |
Unit cell lengths | 45.756, 84.928, 123.911 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 70.050 - 2.100 |
R-factor | 0.15674 |
Rwork | 0.154 |
R-free | 0.21420 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 1ERK |
RMSD bond length | 0.018 |
RMSD bond angle | 1.879 |
Data scaling software | SCALEPACK |
Refinement software | REFMAC (5.8.0155) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 37.300 | 2.160 |
High resolution limit [Å] | 2.100 | 2.100 |
Rmerge | 0.042 | 0.242 |
Number of reflections | 25393 | |
<I/σ(I)> | 20 | 5.3 |
Completeness [%] | 86.0 | 65.6 |
Redundancy | 8.1 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 289.15 | 18% polyethylene glycol (PEG) 8000, 0.2 M Mg(OAc)2, 0.1 M Hepes, pH 7.0 |