360D

STRUCTURE OF 2,5-BIS{[4-(N-ETHYLAMIDINO)PHENYL]}FURAN COMPLEXED TO 5'-D(CPGPCPGPAPAPTPTPCPGPCPG)-3'. A MINOR GROOVE DRUG COMPLEX, SHOWING PATTERNS OF GROOVE HYDRATION

Summary for 360D

DescriptorDNA (5'-D(*CP*GP*CP*GP*AP*AP*TP*TP*CP*GP*CP*G)-3'), MAGNESIUM ION, N,N'-(furan-2,5-diylbis{benzene-4,1-diyl[(Z)-aminomethylylidene]})diethanaminium, ... (4 entities in total)
Functional Keywordsb-dna, double helix, complexed with drug, dna
Biological sourcesynthetic construct
Total number of polymer chains2
Total molecular weight7713.56
Authors
Guerri, A.,Simpson, I.J.,Neidle, S. (deposition date: 1997-10-29, release date: 1998-07-16, Last modification date: 2020-04-08)
Primary citation
Guerri, A.,Simpson, I.J.,Neidle, S.
Visualisation of extensive water ribbons and networks in a DNA minor-groove drug complex.
Nucleic Acids Res., 26:2873-2878, 1998
PubMed: 9611230 (PDB entries with the same primary citation)
DOI: 10.1093/nar/26.12.2873
MImport into Mendeley
Experimental method
X-RAY DIFFRACTION (1.85 Å)
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Structure validation

ClashscoreRSRZ outliers40MetricValuePercentile RanksWorseBetterPercentile relative to all X-ray structuresPercentile relative to X-ray structures of similar resolution
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PDB entries from 2020-08-12