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- aggregation classification "A1".
- aggregation creator B443646.
- aggregation creator B443647.
- aggregation creator B443648.
- aggregation creator person.
- aggregation date "2005".
- aggregation format "application/pdf".
- aggregation hasFormat 2045981.bibtex.
- aggregation hasFormat 2045981.csv.
- aggregation hasFormat 2045981.dc.
- aggregation hasFormat 2045981.didl.
- aggregation hasFormat 2045981.doc.
- aggregation hasFormat 2045981.json.
- aggregation hasFormat 2045981.mets.
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- aggregation hasFormat 2045981.txt.
- aggregation hasFormat 2045981.xls.
- aggregation hasFormat 2045981.yaml.
- aggregation isPartOf urn:issn:1742-464X.
- aggregation language "eng".
- aggregation rights "I have transferred the copyright for this publication to the publisher".
- aggregation subject "Physics and Astronomy".
- aggregation title "Netropsin interactions in the minor groove of d(GGCCAATTGG) studied by a combination of resolution enhancement and ab initio calculations".
- aggregation abstract "The structure of the complex between the minor groove binder netropsin and d(GGCCAATTGG) was determined via single-crystal X-ray techniques. The structure was refined to completion using < smallcapitals > refmac </smallcapitals > 5.1.24, resulting in a residual R-factor of 20.0% (including 68 water molecules). Using crystal engineering and cryocooling techniques, the resolution could be enhanced to 1.75 angstrom, resulting in an unambiguous determination of the drug conformation and orientation. As previously noticed, bifurcated hydrogen bonds are formed between the amide nitrogen atoms of the drug and the N3 and O2 atoms of A and T base pairs, respectively, clearly cataloging the structure to class I. As the bulky NH2 group on guanine was believed to prevent binding of the drug in the minor groove, the detailed nature of several of the amidinium and guanidinium end contacts were further investigated by ab initio quantum chemical methods.".
- aggregation authorList BK774756.
- aggregation endPage "3541".
- aggregation issue "14".
- aggregation startPage "3531".
- aggregation volume "272".
- aggregation aggregates 2079968.
- aggregation isDescribedBy 2045981.
- aggregation similarTo j.1742-4658.2005.04773.x.
- aggregation similarTo LU-2045981.