5T0Z
PelC from Geobacter metallireducens
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | NSLS BEAMLINE X29A |
| Synchrotron site | NSLS |
| Beamline | X29A |
| Temperature [K] | 100 |
| Detector technology | CCD |
| Collection date | 2012-10-04 |
| Detector | ADSC QUANTUM 315 |
| Wavelength(s) | 0.9792 |
| Spacegroup name | P 1 21 1 |
| Unit cell lengths | 59.931, 78.298, 85.136 |
| Unit cell angles | 90.00, 105.86, 90.00 |
Refinement procedure
| Resolution | 46.423 - 2.255 |
| R-factor | 0.1756 |
| Rwork | 0.173 |
| R-free | 0.21980 |
| Structure solution method | SAD |
| RMSD bond length | 0.007 |
| RMSD bond angle | 0.864 |
| Data reduction software | DENZO |
| Data scaling software | SCALEPACK |
| Phasing software | HKL-3000 |
| Refinement software | PHENIX ((1.10_2155: ???)) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 50.000 | 2.330 |
| High resolution limit [Å] | 2.250 | 2.250 |
| Rmerge | 0.085 | 0.696 |
| Number of reflections | 71358 | |
| <I/σ(I)> | 15.6 | |
| Completeness [%] | 99.9 | 99.5 |
| Redundancy | 8.2 | 6.6 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 298 | 0.1 M sodium cacodylate pH 6.5, 40% (v/v) MPD, 5% (w/v) PEG 8000 |
