3P7O
Rat Insulin Degrading Enzyme (Insulysin) E111F mutant with two bound peptides
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | APS BEAMLINE 22-ID |
Synchrotron site | APS |
Beamline | 22-ID |
Temperature [K] | 110 |
Detector technology | CCD |
Collection date | 2008-08-21 |
Detector | MARMOSAIC 300 mm CCD |
Wavelength(s) | 1.0000 |
Spacegroup name | C 1 2 1 |
Unit cell lengths | 115.520, 70.910, 114.360 |
Unit cell angles | 90.00, 92.97, 90.00 |
Refinement procedure
Resolution | 28.840 - 2.142 |
R-factor | 0.2154 |
Rwork | 0.208 |
R-free | 0.28460 |
Structure solution method | MOLECULAR REPLACEMENT |
RMSD bond length | 0.009 |
RMSD bond angle | 1.158 |
Data reduction software | HKL-2000 |
Data scaling software | HKL-2000 |
Phasing software | PHASER |
Refinement software | PHENIX ((phenix.refine: 1.6.1_357)) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 50.000 | 2.240 |
High resolution limit [Å] | 2.140 | 2.140 |
Rmerge | 0.088 | 0.410 |
Number of reflections | 47233 | |
<I/σ(I)> | 14.96 | 3.98 |
Completeness [%] | 98.7 | 99.6 |
Redundancy | 2.8 | 2 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 6.5 | 298 | 100 mM sodium citrate pH 6.5, 100 mM ammonium acetate, 20% PEG 4000, 8 mg/ml protein, VAPOR DIFFUSION, HANGING DROP, temperature 298K |