2RL0
Crystal structure of the fourth and fifth fibronectin F1 modules in complex with a fragment of staphylococcus aureus fnbpa-5
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | ESRF BEAMLINE ID14-2 |
Synchrotron site | ESRF |
Beamline | ID14-2 |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2006-02-02 |
Detector | ADSC QUANTUM 4 |
Wavelength(s) | 0.93300 |
Spacegroup name | P 41 21 2 |
Unit cell lengths | 85.580, 85.580, 230.860 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 28.160 - 2.000 |
R-factor | 0.221 |
Rwork | 0.218 |
R-free | 0.26600 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | Previous low resolution structure |
RMSD bond length | 0.016 |
RMSD bond angle | 1.552 |
Data reduction software | MOSFLM |
Data scaling software | SCALA |
Phasing software | MOLREP |
Refinement software | REFMAC |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 28.161 | 2.110 |
High resolution limit [Å] | 2.000 | 2.000 |
Rmerge | 0.059 | 0.300 |
Total number of observations | 42415 | |
Number of reflections | 58383 | |
<I/σ(I)> | 22.5 | 3.8 |
Completeness [%] | 99.1 | 97.5 |
Redundancy | 7.3 | 5.1 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, SITTING DROP | 6.2 | 291 | 0.2M NACL, 0.1M BIS TRIS, 14% PEG3350, pH6.2, VAPOR DIFFUSION, SITTING DROP, temperature 291K |