1D35
FACILE FORMATION OF A CROSSLINKED ADDUCT BETWEEN DNA AND THE DAUNORUBICIN DERIVATIVE MAR70 MEDIATED BY FORMALDEHYDE: MOLECULAR STRUCTURE OF THE MAR70-D(CGTNACG) COVALENT ADDUC
Experimental procedure
Source type | ROTATING ANODE |
Detector technology | DIFFRACTOMETER |
Detector | RIGAKU AFC-5R |
Spacegroup name | P 41 21 2 |
Unit cell lengths | 28.120, 28.120, 52.980 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | ? - 1.300 |
R-factor | 0.174 |
RMSD bond length | 0.013 * |
RMSD bond angle | 1.980 * |
Refinement software | NUCLSQ |
Data quality characteristics
Overall | |
High resolution limit [Å] | 1.300 |
Number of reflections | 2599 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION | 6 | 295 | pH 6.00, VAPOR DIFFUSION, temperature 295.00K |
Crystallization Reagents
ID | crystal ID | solution ID | reagent name | concentration | details |
1 | 1 | 1 | WATER | ||
2 | 1 | 1 | MPD | ||
3 | 1 | 1 | HCHO | ||
4 | 1 | 1 | BACL2 | ||
5 | 1 | 1 | NA CACODYLATE | ||
6 | 1 | 1 | SPERMINE | ||
7 | 1 | 2 | WATER | ||
8 | 1 | 2 | MPD |
Crystallization Reagents in Literatures
ID | crystal ID | solution | reagent name | concentration (unit) | details |
1 | 1 | drop | d(CGTnACG) | 1.2 (mM) | |
2 | 1 | drop | 4 (mM) | ||
3 | 1 | drop | sodium cacodylate | 30 (mM) | |
4 | 1 | drop | spermine | 2.5 (mM) | |
5 | 1 | drop | MAR70 | 1.2 (mM) | |
6 | 1 | drop | MPD | 5 (%(v/v)) | |
7 | 1 | reservoir | MPD | 40 (%(v/v)) |