2IEL
CRYSTAL STRUCTURE OF TT0030 from Thermus Thermophilus
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | APS BEAMLINE 22-ID |
| Synchrotron site | APS |
| Beamline | 22-ID |
| Temperature [K] | 100 |
| Detector technology | CCD |
| Collection date | 2006-08-17 |
| Detector | MARMOSAIC 300 mm CCD |
| Wavelength(s) | 0.979 |
| Spacegroup name | I 4 |
| Unit cell lengths | 89.584, 89.584, 66.685 |
| Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
| Resolution | 18.590 - 1.600 |
| R-factor | 0.26794 |
| Rwork | 0.257 |
| R-free | 0.27910 |
| Structure solution method | SAD |
| RMSD bond length | 0.009 |
| RMSD bond angle | 1.156 |
| Data reduction software | HKL-2000 |
| Data scaling software | SCALEPACK |
| Phasing software | SCA2STRUCTURE |
| Refinement software | REFMAC (5.2.0019) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 50.000 | 1.690 |
| High resolution limit [Å] | 1.600 | 1.600 |
| Number of reflections | 30385 | |
| <I/σ(I)> | 57.1 | 2.77 |
| Completeness [%] | 71.8 | 30.6 |
| Redundancy | 12.2 | 2.6 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | MICROBATCH UNDER OIL | 6.9 | 291 | MODIFIED MICROBATCH USING 1.0 MICROLITER DROPS CONTAINING EQUAL VOLUMES OF PROTEIN CONCENTRATE (28.3 mg/ml) AND SOLUTION CONTAING 10% GLYCEROL, 1.26M TR-ISODIUM CITRATE DIHYDRATE, 0.09M HEPES pH 7.5, Temperature 291K., pH 6.9, MICROBATCH UNDER OIL |
