3SGL
The crystal structure of MnmC from Yersinia pestis bound with FAD and SAM
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 | 2010-11-11 |
| Detector | ADSC QUANTUM 315r |
| Wavelength(s) | 0.9790 |
| Spacegroup name | P 1 21 1 |
| Unit cell lengths | 66.085, 59.815, 100.797 |
| Unit cell angles | 90.00, 100.18, 90.00 |
Refinement procedure
| Resolution | 50.000 - 2.700 |
| R-factor | 0.18413 |
| Rwork | 0.180 |
| R-free | 0.25933 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 3pvc |
| RMSD bond length | 0.013 |
| RMSD bond angle | 1.491 |
| Data reduction software | HKL-2000 |
| Data scaling software | HKL-2000 |
| Phasing software | MOLREP |
| Refinement software | REFMAC (5.5.0109) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 50.000 | 2.750 |
| High resolution limit [Å] | 2.700 | 2.700 |
| Rmerge | 0.143 | 0.734 |
| Number of reflections | 21571 | |
| <I/σ(I)> | 9.3 | 2.1 |
| Completeness [%] | 100.0 | 100 |
| Redundancy | 5.1 | 5.2 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, SITTING DROP | 7 | 310 | 0.1M HEPES PH 7.0 30% (v/v) Jeffamine ED-2001 PH 7.0, VAPOR DIFFUSION, SITTING DROP, temperature 100K, temperature 310K |
