4YYR
Ficin B crystal form I
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | SOLEIL BEAMLINE PROXIMA 1 |
Synchrotron site | SOLEIL |
Beamline | PROXIMA 1 |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2013-03-12 |
Detector | ADSC QUANTUM 315r |
Wavelength(s) | 0.9801 |
Spacegroup name | P 32 2 1 |
Unit cell lengths | 89.902, 89.902, 55.996 |
Unit cell angles | 90.00, 90.00, 120.00 |
Refinement procedure
Resolution | 26.049 - 1.349 |
R-factor | 0.1339 |
Rwork | 0.133 |
R-free | 0.15370 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 4yyq |
RMSD bond length | 0.009 |
RMSD bond angle | 1.322 |
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] | 26.049 | 1.390 |
High resolution limit [Å] | 1.349 | 1.350 |
Rmerge | 0.088 | 0.374 |
Number of reflections | 53284 | |
<I/σ(I)> | 18.1 | 3.3 |
Completeness [%] | 94.7 | 66.6 |
Redundancy | 8.7 | 6.7 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 293 | 2.0 M AS, 0.1 M Na HEPES 7.5, 2% PEG400 |