3E44
Q138F HincII bound to cleaved DNA (GTT | AAC) and Mn2+
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | SSRL BEAMLINE BL9-1 |
| Synchrotron site | SSRL |
| Beamline | BL9-1 |
| Temperature [K] | 100 |
| Collection date | 2007-04-11 |
| Wavelength(s) | 0.913321 |
| Spacegroup name | P 1 21 1 |
| Unit cell lengths | 50.694, 91.788, 66.180 |
| Unit cell angles | 90.00, 105.30, 90.00 |
Refinement procedure
| Resolution | 63.834 - 2.520 |
| R-factor | 0.184 |
| Rwork | 0.180 |
| R-free | 0.25700 |
| RMSD bond length | 0.008 |
| RMSD bond angle | 1.207 |
| Data reduction software | MOSFLM |
| Data scaling software | SCALA |
| Phasing software | CNS |
| Refinement software | PHENIX |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 50.000 | 2.590 |
| High resolution limit [Å] | 2.500 | 2.522 |
| Rmerge | 0.055 | 0.355 |
| Number of reflections | 22903 | |
| <I/σ(I)> | 9.8 | 2 |
| Completeness [%] | 99.4 | 99.9 |
| Redundancy | 3.6 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 7.5 | 290 | PEG 4000, 150 mM NaCl, 10 mM HEPES pH 7.5, 2.5 mM MnCl2, VAPOR DIFFUSION, HANGING DROP, temperature 290K |
Crystallization Reagents
| ID | crystal ID | solution ID | reagent name | concentration | details |
| 1 | 1 | 1 | PEG 4000 | ||
| 2 | 1 | 1 | NaCl | ||
| 3 | 1 | 1 | HEPES | ||
| 4 | 1 | 1 | MnCl2 | ||
| 5 | 1 | 2 | PEG 4000 | ||
| 6 | 1 | 2 | NaCl | ||
| 7 | 1 | 2 | HEPES | ||
| 8 | 1 | 2 | MnCl2 |
