392D
STRUCTURAL VARIABILITY AND NEW INTERMOLECULAR INTERACTIONS OF Z-DNA IN CRYSTALS OF D(PCPGPCPGPCPG)
Experimental procedure
| Source type | SEALED TUBE |
| Source details | OTHER |
| Temperature [K] | 290 |
| Detector technology | DIFFRACTOMETER |
| Collection date | 1988-01-01 |
| Detector | SYNTEX P21 |
| Spacegroup name | C 2 2 21 |
| Unit cell lengths | 45.800, 37.300, 70.300 |
| Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
| Resolution | 8.000 - 3.000 |
| R-factor | 0.182 |
| Rwork | 0.182 |
| R-free | 0.24500 |
| RMSD bond length | 0.013 |
| RMSD bond angle | 1.570 |
| Data reduction software | SYNTEX (P21) |
| Data scaling software | SYNTEX (P21) |
| Refinement software | X-PLOR (3.851) |
Data quality characteristics
| Overall | |
| Low resolution limit [Å] | 35.200 |
| High resolution limit [Å] | 3.000 |
| Rmerge | 0.080 |
| Number of reflections | 1276 |
| Completeness [%] | 97.9 |
| Redundancy | 2 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | other * | 6 | Malinina, L., (1991) J. Crystal Growth, 110, 252. * |
Crystallization Reagents
| ID | crystal ID | solution ID | reagent name | concentration | details |
| 1 | 1 | 1 | WATER | ||
| 2 | 1 | 1 | MGCL2 | ||
| 3 | 1 | 1 | SPERMINE TETRACLORIDE | ||
| 4 | 1 | 1 | NA CACODYLATE | ||
| 5 | 1 | 1 | 2-METHYL-2,4-PENTANEDIOL | ||
| 6 | 1 | 2 | WATER | ||
| 7 | 1 | 2 | 2-METHYL-2,4-PENTANEDIOL |
