4WUI
Crystal structure of TrpF from Jonesia denitrificans
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | APS BEAMLINE 19-ID |
| Synchrotron site | APS |
| Beamline | 19-ID |
| Temperature [K] | 100 |
| Detector technology | CCD |
| Collection date | 2013-10-11 |
| Detector | ADSC QUANTUM 315r |
| Wavelength(s) | 0.9793 |
| Spacegroup name | P 21 21 21 |
| Unit cell lengths | 49.423, 64.289, 66.414 |
| Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
| Resolution | 24.712 - 1.090 |
| R-factor | 0.1281 |
| Rwork | 0.128 |
| R-free | 0.13760 |
| Structure solution method | MAD |
| RMSD bond length | 0.011 |
| RMSD bond angle | 1.514 |
| Data scaling software | HKL-3000 |
| Phasing software | HKL-3000 |
| Refinement software | PHENIX ((phenix.refine: 1.9_1692)) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 25.000 | 1.110 |
| High resolution limit [Å] | 1.090 | 1.090 |
| Rmerge | 0.066 | 0.795 |
| Number of reflections | 88243 | |
| <I/σ(I)> | 32.6 | 2.4 |
| Completeness [%] | 99.6 | 95.7 |
| Redundancy | 9.6 | 6.4 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, SITTING DROP | 7 | 289 | 0.1 M Bis/Tris propane:NaOH, pH 7, 2 M (NH4)2HCITRATE, no extra cryo |
