✦ LIBER ✦

First−Second Shell Interactions in Metal Binding Sites in Proteins: A PDB Survey and DFT/CDM Calculations

✍ Scribed by Dudev, Todor; Lin, ; Dudev, Minko; Lim, Carmay

Book ID: 121234682
Publisher: American Chemical Society
Year: 2003
Tongue: English
Weight: 371 KB
Volume: 125
Category: Article
ISSN: 0002-7863
DOI: 10.1021/ja0209722

No coin nor oath required. For personal study only.

📜 SIMILAR VOLUMES

A comparative study of semiempirical, ab

A comparative study of semiempirical, ab initio, and DFT methods in evaluating metal–ligand bond strength, proton affinity, and interactions between first and second shell ligands in Zn-biomimetic complexes

✍ Gilles Frison; Gilles Ohanessian 📂 Article 📅 2007 🏛 John Wiley and Sons 🌐 English ⚖ 431 KB

## Abstract Although theoretical methods are now available which give very accurate results, often comparable to the experimental ones, modeling chemical or biological interesting systems often requires less demanding and less accurate theoretical methods, mainly due to computer limitations. Theref

Dissecting the General Physicochemical P

Dissecting the General Physicochemical Properties of Noncovalent Interactions Involving Tyrosine Side Chain as a Second-Shell Ligand in Biomolecular Metal-Binding Site Mimetics: An Experimental Study Combining Fluorescence, 13C NMR Spectroscopy and ESI Mass Spectrometry

✍ Chi Ming Yang; Xueying Li; Wei Wei; Yitong Li; Zhengjuan Duan; Jianyu Zheng; Tai 📂 Article 📅 2007 🏛 John Wiley and Sons 🌐 English ⚖ 564 KB