2B0K

Crystal structure of the DB921-D(CGCGAATTCGCG)2 complex.

Summary for 2B0K

Related2DBE
Descriptor5'-D(*CP*GP*CP*GP*AP*AP*TP*TP*CP*GP*CP*G)-3', MAGNESIUM ION, 2-(4'-AMIDINOBIPHENYL-4-YL)-1H-BENZIMIDAZOLE-5-AMIDINE, ... (4 entities in total)
Functional Keywordsnucleic acids, dna, double helix, minor groove, dna minor groove binder, dna minor groove-ligand complex, db921, a2t2, dickerson and drew dna, crystal structure of b-dna, dna-drug complex, magnesium-water complex, hydrated magnesium, dna hydration.
Total number of polymer chains2
Total molecular weight7705.5
Authors
Miao, Y.,Lee, M.P.,Parkinson, G.N.,Batista-Parra, A.,Ismail, M.A.,Neidle, S.,Boykin, D.W.,Wilson, W.D. (deposition date: 2005-09-14, release date: 2005-11-22, Last modification date: 2019-07-24)
Primary citation
Miao, Y.,Lee, M.P.,Parkinson, G.N.,Batista-Parra, A.,Ismail, M.A.,Neidle, S.,Boykin, D.W.,Wilson, W.D.
Out-of-Shape DNA Minor Groove Binders: Induced Fit Interactions of Heterocyclic Dications with the DNA Minor Groove.
Biochemistry, 44:14701-14708, 2005
PubMed: 16274217 (PDB entries with the same primary citation)
DOI: 10.1021/bi051791q
MImport into Mendeley
Experimental method
X-RAY DIFFRACTION (1.64 Å)
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Structure validation

RfreeClashscoreRSRZ outliers 0.28440MetricValuePercentile RanksWorseBetterPercentile relative to all X-ray structuresPercentile relative to X-ray structures of similar resolution
Download full validation report