3MGV
Cre recombinase-DNA transition state
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | ALS BEAMLINE 8.2.1 |
| Synchrotron site | ALS |
| Beamline | 8.2.1 |
| Detector technology | CCD |
| Collection date | 2007-07-08 |
| Detector | ADSC QUANTUM 315r |
| Wavelength(s) | 1.0 |
| Spacegroup name | P 32 2 1 |
| Unit cell lengths | 136.046, 136.046, 218.431 |
| Unit cell angles | 90.00, 90.00, 120.00 |
Refinement procedure
| Resolution | 49.570 - 2.290 |
| R-factor | 0.19426 |
| Rwork | 0.193 |
| R-free | 0.22218 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 2hoi |
| RMSD bond length | 0.013 |
| RMSD bond angle | 1.619 |
| Data reduction software | HKL-2000 |
| Data scaling software | HKL-2000 |
| Phasing software | AMoRE |
| Refinement software | REFMAC (5.5.0102) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 50.000 | 2.380 |
| High resolution limit [Å] | 2.290 | 2.290 |
| Number of reflections | 102079 | |
| <I/σ(I)> | 4.15 | |
| Completeness [%] | 97.2 | 95.4 |
| Redundancy | 7.1 | 7.3 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 5.6 | 293.15 | 0.02M calcium chloride, 0.02M sodium acetate, MPD, pH 5.6, VAPOR DIFFUSION, HANGING DROP, temperature 293.15K |
Crystallization Reagents
| ID | crystal ID | solution ID | reagent name | concentration | details |
| 1 | 1 | 1 | calcium chloride | ||
| 2 | 1 | 1 | sodium acetate | ||
| 3 | 1 | 1 | MPD | ||
| 4 | 1 | 2 | calcium chloride | ||
| 5 | 1 | 2 | sodium acetate | ||
| 6 | 1 | 2 | MPD |
