2RKZ
Crystal structure of the second and third fibronectin f1 modules in complex with a fragment of staphylococcus aureus fnbpa-1
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | ESRF BEAMLINE ID29 |
| Synchrotron site | ESRF |
| Beamline | ID29 |
| Temperature [K] | 100 |
| Detector technology | CCD |
| Collection date | 2006-07-25 |
| Detector | ADSC QUANTUM 315 |
| Wavelength(s) | 0.97620 |
| Spacegroup name | P 1 21 1 |
| Unit cell lengths | 59.590, 109.720, 71.470 |
| Unit cell angles | 90.00, 96.94, 90.00 |
Refinement procedure
| Resolution | 25.580 - 2.000 |
| R-factor | 0.2 |
| Rwork | 0.197 |
| R-free | 0.26100 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | A previous lower resolution structure |
| RMSD bond length | 0.014 |
| RMSD bond angle | 1.423 |
| Data reduction software | MOSFLM |
| Data scaling software | SCALA |
| Phasing software | PHASER |
| Refinement software | REFMAC (5.4.0013) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 26.038 | 2.110 |
| High resolution limit [Å] | 2.000 | 2.000 |
| Rmerge | 0.100 | 0.272 |
| Total number of observations | 33090 | |
| Number of reflections | 58424 | |
| <I/σ(I)> | 11.5 | 4.2 |
| Completeness [%] | 99.9 | 100 |
| Redundancy | 3.6 | 3.7 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, SITTING DROP | 7 | 291 | 0.8M SUCCINIC ACID, pH7.0, VAPOR DIFFUSION, SITTING DROP, temperature 291K |
