Unrestrained 5 ns molecular dynamics simulation of a cisplatin-DNA 1,2-GG adduct provides a rationale for the NMR features and reveals increased conformational flexibility at the platinum binding site

Journal of Molecular Biology

Volumn 314, Issue 5, 2001, Pages 1227-1243

  Elizondo Riojas, Miguel Angel ^a   Kozelka, Jiří ^a  

^a UNIVERSITÉ PARIS DESCARTES   (France)

Author keywords

BI BII transitions; Cisplatin; HMG1; LEF 1; Molecular dynamics simulations

Indexed keywords

CISPLATIN; CYTOSINE; DNA; GUANINE; HIGH MOBILITY GROUP PROTEIN; LYMPHOID ENHANCER FACTOR 1; PHOSPHATE; PLATINUM;

ARTICLE; CONFORMATIONAL TRANSITION; CROSS LINKING; DNA ADDUCT; DNA CONFORMATION; DNA STRUCTURE; DRUG DNA BINDING; HYDROGEN BOND; MOLECULAR DYNAMICS; MOLECULAR RECOGNITION; NUCLEAR MAGNETIC RESONANCE SPECTROSCOPY; PRIORITY JOURNAL; SIMULATION;

EID: 0035861989     PISSN: 00222836     EISSN: None     Source Type: Journal    
DOI: 10.1006/jmbi.2000.5216     Document Type: Article

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