5VBJ

Sulfur as a bromine biomolecular halogen-bond acceptor

Summary for 5VBJ

DescriptorDNA (5'-D(*CP*CP*GP*AP*TP*(AS)P*(BRU)P*CP*GP*G)-3'), CALCIUM ION (3 entities in total)
Functional Keywordsbiophysics, bromine, dna, sulfur, halogen bonding, models, molecular, molecular conformation, uracil
Biological sourcesynthetic construct
Total number of polymer chains2
Total molecular weight6291.96
Authors
Ford, M.C.,Ho, P.S. (deposition date: 2017-03-29, release date: 2017-08-09, Last modification date: 2019-11-27)
Primary citation
Ford, M.C.,Saxton, M.,Ho, P.S.
Sulfur as an Acceptor to Bromine in Biomolecular Halogen Bonds.
J Phys Chem Lett, 8:4246-4252, 2017
PubMed: 28796521 (PDB entries with the same primary citation)
DOI: 10.1021/acs.jpclett.7b01725
MImport into Mendeley
Experimental method
X-RAY DIFFRACTION (1.944 Å)
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Structure validation

RfreeClashscoreRSRZ outliers 0.276100MetricValuePercentile RanksWorseBetterPercentile relative to all X-ray structuresPercentile relative to X-ray structures of similar resolution
Download full validation reportDownload