5TPI
1.47 Angstrom Crystal Structure of the C-terminal Substrate Binding Domain of LysR Family Transcriptional Regulator from Klebsiella pneumoniae.
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | APS BEAMLINE 21-ID-G |
| Synchrotron site | APS |
| Beamline | 21-ID-G |
| Temperature [K] | 100 |
| Detector technology | CCD |
| Collection date | 2016-10-14 |
| Detector | MARMOSAIC 300 mm CCD |
| Wavelength(s) | 0.97856 |
| Spacegroup name | C 1 2 1 |
| Unit cell lengths | 93.756, 40.228, 68.211 |
| Unit cell angles | 90.00, 129.41, 90.00 |
Refinement procedure
| Resolution | 26.350 - 1.470 |
| R-factor | 0.13886 |
| Rwork | 0.137 |
| R-free | 0.18060 |
| Structure solution method | SAD |
| RMSD bond length | 0.009 |
| RMSD bond angle | 1.394 |
| Data reduction software | HKL-3000 |
| Data scaling software | HKL-3000 |
| Phasing software | PHENIX |
| Refinement software | REFMAC (5.8.0155) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 30.000 | 1.500 |
| High resolution limit [Å] | 1.470 | 1.470 |
| Rmerge | 0.037 | 0.638 |
| Number of reflections | 33672 | |
| <I/σ(I)> | 35.8 | 2.3 |
| Completeness [%] | 99.6 | 99.7 |
| Redundancy | 4.5 | 4.3 |
| CC(1/2) | 0.837 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 7 | 295 | Protein: 18.0 mg/ml, 0.3M Sodium chloride, 0.01M HEPES pH 7.5, Screen: 3.2M NaCl, 0.1M Bis-Tris-propane (pH=7.0); Cryo: Paratone. |
