3PE9
Structures of Clostridium thermocellum CbhA fibronectin(III)-like modules
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | ROTATING ANODE |
| Source details | BRUKER AXS MICROSTAR |
| Temperature [K] | 100 |
| Detector technology | CCD |
| Collection date | 2009-01-09 |
| Detector | Bruker Platinum 135 |
| Wavelength(s) | 1.5418 |
| Spacegroup name | P 1 21 1 |
| Unit cell lengths | 42.128, 103.281, 45.632 |
| Unit cell angles | 90.00, 106.53, 90.00 |
Refinement procedure
| Resolution | 25.000 - 1.690 |
| R-factor | 0.18442 |
| Rwork | 0.182 |
| R-free | 0.22861 |
| Structure solution method | SAD |
| RMSD bond length | 0.022 |
| RMSD bond angle | 1.902 |
| Data reduction software | SAINT |
| Data scaling software | PROTEUM PLUS |
| Phasing software | SHELX |
| Refinement software | REFMAC (5.5.0109) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 25.000 | 1.780 |
| High resolution limit [Å] | 1.690 | 1.690 |
| Number of reflections | 41325 | |
| <I/σ(I)> | 2.53 | |
| Completeness [%] | 98.8 | 97.6 |
| Redundancy | 5.67 | 2.84 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION | 6.2 | 0.2 M Ammonium iodide and 20% (w/v) Polyethylene glycol 3,350, pH 6.2, VAPOR DIFFUSION, temperature 100K |
