4IIY
Structure of MccF in complex with glutamyl sulfamoyl inosine
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | APS BEAMLINE 21-ID-F |
| Synchrotron site | APS |
| Beamline | 21-ID-F |
| Temperature [K] | 100 |
| Detector technology | CCD |
| Collection date | 2012-04-02 |
| Detector | MARMOSAIC 225 mm CCD |
| Wavelength(s) | 0.97872 |
| Spacegroup name | P 1 21 1 |
| Unit cell lengths | 54.525, 86.087, 73.225 |
| Unit cell angles | 90.00, 101.19, 90.00 |
Refinement procedure
| Resolution | 33.534 - 1.200 |
| R-factor | 0.1642 |
| Rwork | 0.164 |
| R-free | 0.17510 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 3tla |
| RMSD bond length | 0.005 |
| RMSD bond angle | 1.140 |
| Data reduction software | DENZO |
| Data scaling software | SCALEPACK |
| Phasing software | PHENIX |
| Refinement software | PHENIX (1.7.1_743) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 71.832 | 1.220 |
| High resolution limit [Å] | 1.200 | 1.200 |
| Rmerge | 0.041 | 0.539 |
| Number of reflections | 203462 | |
| <I/σ(I)> | 27.5 | 2 |
| Completeness [%] | 98.5 | |
| Redundancy | 5.8 | 5.3 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION | 7.5 | 282 | 0.1 M Tris, pH 7.5, 8% PEG8000, VAPOR DIFFUSION, temperature 282K |
