3G3C
Mth0212 (WT) in complex with a 6bp dsDNA containing a single one nucleotide long 3'-overhang
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 | 2008-02-06 |
| Detector | MAR CCD 165 mm |
| Wavelength(s) | 0.91841 |
| Spacegroup name | P 21 21 2 |
| Unit cell lengths | 100.354, 79.337, 98.550 |
| Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
| Resolution | 15.000 - 3.040 |
| R-factor | 0.23894 |
| Rwork | 0.236 |
| R-free | 0.29432 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 3fzi |
| RMSD bond length | 0.008 |
| RMSD bond angle | 1.112 |
| Data reduction software | DENZO |
| Data scaling software | SCALEPACK |
| Phasing software | MOLREP |
| Refinement software | REFMAC |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 50.000 | 3.150 |
| High resolution limit [Å] | 3.040 | 3.040 |
| Number of reflections | 15706 | |
| <I/σ(I)> | 26.3 | 4.1 |
| Completeness [%] | 100.0 | 100 |
| Redundancy | 7.3 | 6.8 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, SITTING DROP | 7 | 293 | reservoir: 40mM MgAc/50mM NaCac pH 6.0, 20% MPD; complex solution: 50mM KCl, 10mM KH2PO4/K2HPO4 pH 7.0, 1mM MgCl2, VAPOR DIFFUSION, SITTING DROP, temperature 293K |
Crystallization Reagents
| ID | crystal ID | solution ID | reagent name | concentration | details |
| 1 | 1 | 1 | KCl | ||
| 2 | 1 | 1 | KH2PO4/K2HPO4 | ||
| 3 | 1 | 1 | MgCl2 | ||
| 4 | 1 | 1 | H2O | ||
| 5 | 1 | 2 | MgAc | ||
| 6 | 1 | 2 | NaCac | ||
| 7 | 1 | 2 | MPD | ||
| 8 | 1 | 2 | H2O |
