Computer simulation of molecular dynamics: methodology, applications, and perspectives in chemistry

WF Van Gunsteren… - … International Edition in …, 1990 - Wiley Online Library
During recent decades it has become feasible to simulate the dynamics of molecular
systems on a computer. The method of molecular dynamics (MD) solves Newton's equations …

Structural studies of protein–nucleic acid interaction: the sources of sequence-specific binding

TA Steitz - Quarterly reviews of biophysics, 1990 - cambridge.org
Structural studies of DNA-binding proteins and their complexes with DNA have proceeded at
an accelerating pace in recent years due to important technical advances in molecular …

Interfacial Catalysis: the Mechanism of Phospholipase A2

DL Scott, SP White, Z Otwinowski, W Yuan, MH Gelb… - Science, 1990 - science.org
A chemical description of the action of phospholipase A2 (PLA2) can now be inferred with
confidence from three high-resolution x-ray crystal structures. The first is the structure of the …

Crystal structure of an engrailed homeodomain-DNA complex at 2.8 Å resolution: a framework for understanding homeodomain-DNA interactions

CR Kissinger, B Liu, E Martin-Blanco, TB Kornberg… - Cell, 1990 - cell.com
The crystal structure of a complex containing the engrailed homeodom $ n and a duplex
DNA site has been determlned at 2.8 A resolution and refined to a crystallographic R factor …

The b alleles of U. maydis, whose combinations program pathogenic development, code for polypeptides containing a homeodomain-related motif

B Schulz, F Banuett, M Dahl, R Schlesinger, W Schäfer… - Cell, 1990 - cell.com
U. maydis is a fungal pathogen of corn with two forms: one is yeast-like and nonpathogenic;
the other is filamentous and pathogenic. The b locus, with 25 different alleles, regulates this …

Hydrogen bond stereochemistry in protein structure and function

JA Ippolito, RS Alexander, DW Christianson - Journal of molecular biology, 1990 - Elsevier
Fifty high resolution protein structures from the Brookhaven Protein Data Bank have been
analyzed for recurring motifs in hydrogen bond stereochemistry. Although an exhaustive …

Design of DNA-binding peptides based on the leucine zipper motif

KT O'Neil, RH Hoess, WF DeGrado - Science, 1990 - science.org
A class of transcriptional regulator proteins bind to DNA at dyad-symmetric sites through a
motif consisting of (i) a" leucine zipper" sequence that associates into noncovalent, parallel …

The energetic basis of specificity in the Eco RI endonuclease—DNA interaction

DR Lesser, MR Kurpiewski, L Jen-Jacobson - Science, 1990 - science.org
High sequence selectivity in DNA-protein interactions was analyzed by measuring
discrimination by Eco RI endonuclease between the recognition site GAATTC and …

Binding modes of distamycin A with d (CGCAAATTTGCG) 2 determined by two-dimensional NMR

JG Pelton, DE Wemmer - Journal of the American Chemical …, 1990 - ACS Publications
Two-dimensional nuclear Overhauser effect spectroscopy (NOESY) was used to study the
interactionof distamycin A with d (CGCAAATTTGCG) j. Spectra acquired at several points in …

DNA binding properties of the purified Antennapedia homeodomain.

M Affolter, A Percival-Smith, M Müller… - Proceedings of the …, 1990 - National Acad Sciences
The in vitro DNA binding properties of a purified 68-amino acid Antennapedia
homeodomain (Antp HD) peptide have been analyzed. Equilibrium and kinetic binding …