4LQB
Crystal structure of uncharacterized protein Kfla3161
Experimental procedure
| Experimental method | MAD |
| Source type | SYNCHROTRON |
| Source details | APS BEAMLINE 19-ID |
| Synchrotron site | APS |
| Beamline | 19-ID |
| Temperature [K] | 100 |
| Detector technology | CCD |
| Collection date | 2012-07-08 |
| Detector | ADSC QUANTUM 315r |
| Wavelength(s) | 0.97935, 0.97948 |
| Spacegroup name | P 21 21 21 |
| Unit cell lengths | 49.610, 56.053, 80.436 |
| Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
| Resolution | 37.180 - 1.720 |
| R-factor | 0.1416 |
| Rwork | 0.140 |
| R-free | 0.18340 |
| Structure solution method | MAD |
| RMSD bond length | 0.005 |
| RMSD bond angle | 1.145 |
| Data reduction software | HKL-3000 |
| Data scaling software | HKL-3000 |
| Phasing software | HKL-3000 |
| Refinement software | REFMAC (5.7.0029) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 50.000 | 1.750 |
| High resolution limit [Å] | 1.720 | 1.720 |
| Rmerge | 0.107 | 0.763 |
| Number of reflections | 24257 | |
| <I/σ(I)> | 17.8 | 2.15 |
| Completeness [%] | 99.0 | 99.5 |
| Redundancy | 5.9 | 4.5 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, SITTING DROP | 6.5 | 289 | 0.2M di-Ammonium hydrogen citrate, 20% PEG3350, pH 6.5, VAPOR DIFFUSION, SITTING DROP, temperature 289K |
