1FMS

Structure of complex between cyclohexyl-bis-furamidine and d(CGCGAATTCGCG)

Summary for 1FMS

Descriptor5'-D(*CP*GP*CP*GP*AP*AP*TP*TP*CP*GP*CP*G)-3', MAGNESIUM ION, 2,5-BIS{[4-(N-CYCLOHEXYLDIAMINOMETHYL)PHENYL]}FURAN, ... (4 entities in total)
Functional Keywordsdna-drug minor groove complex, dna
Total number of polymer chains2
Total molecular weight7823.75
Authors
Simpson, I.J.,Lee, M.,Kumar, A.,Boykin, D.W.,Neidle, S. (deposition date: 2000-08-18, release date: 2000-09-11, Last modification date: 2017-10-04)
Primary citation
Simpson, I.J.,Lee, M.,Kumar, A.,Boykin, D.W.,Neidle, S.
DNA minor groove interactions and the biological activity of 2,5-bis-[4-(N-alkylamidino)phenyl] furans
Bioorg.Med.Chem.Lett., 10:2593-2597, 2000
PubMed: 11128631 (PDB entries with the same primary citation)
DOI: 10.1016/S0960-894X(00)00511-4
MImport into Mendeley
Experimental method
X-RAY DIFFRACTION (1.9 Å)
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Structure validation

Clashscore23MetricValuePercentile RanksWorseBetterPercentile relative to all X-ray structuresPercentile relative to X-ray structures of similar resolution
Download full validation reportDownload
167518
PDB entries from 2020-08-12