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1LEY

STRUCTURE OF A DICATIONIC MONOIMIDAZOLE LEXITROPSIN BOUND TO DNA (ORIENTATION 2)

Experimental procedure
Experimental methodSINGLE WAVELENGTH
Temperature [K]248
Detector technologyDIFFRACTOMETER
DetectorRIGAKU AFC-5R
Spacegroup nameP 21 21 21
Unit cell lengths24.030, 39.260, 66.300
Unit cell angles90.00, 90.00, 90.00
Refinement procedure
Resolution8.000 - 2.250
R-factor0.164
R-free0.23500
RMSD bond length0.030
RMSD bond angle0.069
Refinement softwareNUCLSQ
Data quality characteristics
 Overall
High resolution limit [Å]2.250
Crystallization Conditions
crystal IDmethodpHtemperaturedetails
1Vapor diffusion

*

5

*

VAPOR DIFFUSION, SITTING DROP, temperature 278.00K
Crystallization Reagents
IDcrystal IDsolution IDreagent nameconcentrationdetails
111WATER
211MPD
311MG ACETATE
411SPERMINE_HCL
512WATER
612MPD
Crystallization Reagents in Literatures
IDcrystal IDsolutionreagent nameconcentration (unit)details
11dropDNA duplex0.43 (mM)
21dropmagnesium acetate6.0 (mM)
31dropspermine hydrochloride0.2 (mM)
41dropdrug0.73 (mM)
51dropMPD8.8 (%(w/v))
61reservoir40 (%(w/v))

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PDB entries from 2025-06-18

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