4YYU
Ficin C 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) | 0.901 |
Spacegroup name | P 32 2 1 |
Unit cell lengths | 88.939, 88.939, 56.176 |
Unit cell angles | 90.00, 90.00, 120.00 |
Refinement procedure
Resolution | 31.764 - 1.177 |
R-factor | 0.1403 |
Rwork | 0.139 |
R-free | 0.15660 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 4yyr |
RMSD bond length | 0.009 |
RMSD bond angle | 1.407 |
Data reduction software | MOSFLM |
Data scaling software | SCALA |
Phasing software | PHASER |
Refinement software | PHENIX ((phenix.refine: 1.6.1_357)) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 31.764 | 1.210 |
High resolution limit [Å] | 1.177 | 1.180 |
Rmerge | 0.089 | 0.327 |
Number of reflections | 81464 | |
<I/σ(I)> | 9.9 | 3.5 |
Completeness [%] | 96.4 | 93.6 |
Redundancy | 7.6 | 7.3 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 293 | 30% PEG400, 0.1 M HEPES pH, 0.2 M MgCl2 |