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2D34

FORMALDEHYDE CROSS-LINKS DAUNORUBICIN AND DNA EFFICIENTLY: HPLC AND X-RAY DIFFRACTION STUDIES

Experimental procedure
Source typeROTATING ANODE
Temperature [K]298
Detector technologyDIFFRACTOMETER
DetectorRIGAKU AFC-5R
Spacegroup nameP 41 21 2
Unit cell lengths28.021, 28.021, 52.471
Unit cell angles90.00, 90.00, 90.00
Refinement procedure
Resolution? - 1.500

*

R-factor0.185

*

RMSD bond length0.016

*

Refinement softwareNUCLSQ
Data quality characteristics
 Overall
High resolution limit [Å]1.500
RmergeNaN

*

Number of reflections1746
Crystallization Conditions
crystal IDmethodpHtemperaturedetails
1VAPOR DIFFUSION6pH 6.00, VAPOR DIFFUSION
Crystallization Reagents
IDcrystal IDsolution IDreagent nameconcentrationdetails
111WATER
211MPD
311HCHO
411BACL2
511NA CACODYLATE
611SPERMINE
712WATER
812HCHO
912MPD
Crystallization Reagents in Literatures
IDcrystal IDsolutionreagent nameconcentration (unit)details
11dropd(CGCGCG)1.2 (mM)single strand
21drop4 (mM)
31dropsodium cacodylate30 (mM)
41dropspermine2.5 (mM)
51dropDAU1.2 (mM)
61drop9 (mM)plus 5%(v/v) MPD
71reservoir1 (mM)
81reservoirMPD40 (%)

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PDB entries from 2024-10-16

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