5FBB
S1 nuclease from Aspergillus oryzae in complex with phosphate and adenosine 5'-monophosphate
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | BESSY BEAMLINE 14.2 |
| Synchrotron site | BESSY |
| Beamline | 14.2 |
| Temperature [K] | 100 |
| Detector technology | CCD |
| Collection date | 2013-12-04 |
| Detector | MARMOSAIC 225 mm CCD |
| Wavelength(s) | 0.91841 |
| Spacegroup name | P 1 |
| Unit cell lengths | 42.840, 47.640, 62.600 |
| Unit cell angles | 106.42, 90.09, 106.25 |
Refinement procedure
| Resolution | 35.510 - 1.750 |
| R-factor | 0.14601 |
| Rwork | 0.145 |
| R-free | 0.18815 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | our previous model of S1 |
| RMSD bond length | 0.017 |
| RMSD bond angle | 1.728 |
| Data reduction software | iMOSFLM |
| Data scaling software | Aimless |
| Phasing software | MOLREP |
| Refinement software | REFMAC (5.8.0131) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 35.510 | 1.780 |
| High resolution limit [Å] | 1.750 | 1.750 |
| Rmerge | 0.102 | 0.594 |
| Number of reflections | 43898 | |
| <I/σ(I)> | 8.1 | 2.6 |
| Completeness [%] | 95.8 | 94.7 |
| Redundancy | 2.2 | 2.2 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 6.5 | 291 | 0.05 M Calcium chloride, 0.1 M BIS-TRIS pH 6.5, 30% v/v Polyethylene glycol monomethyl ether 550 |
