Vancomycin: ligand recognition, dimerization and super-complex formation
Article first published online: 11 FEB 2013
© 2013 The Authors Journal compilation © 2013 FEBS
Volume 280, Issue 5, pages 1294–1307, March 2013
How to Cite
Jia, Z., O'Mara, M. L., Zuegg, J., Cooper, M. A. and Mark, A. E. (2013), Vancomycin: ligand recognition, dimerization and super-complex formation. FEBS Journal, 280: 1294–1307. doi: 10.1111/febs.12121
- Issue published online: 26 FEB 2013
- Article first published online: 11 FEB 2013
- Accepted manuscript online: 9 JAN 2013 06:10AM EST
- Manuscript Accepted: 21 DEC 2012
- Manuscript Revised: 19 DEC 2012
- Manuscript Received: 1 NOV 2012
- Australian Grants Commission and the Australian Health and Medical Research Council. Grant Numbers: DP110100327, APP1026922
- NHMRC Australia Fellowship. Grant Number: AF51105
Fig. S1. A plot comparing the root mean squared fluctuations extracted from the simulations together with those inferred from the crystallographic B-factors.
Fig. S2. The hydrogen atom identifiers taken from Grdadolnik et al. 1998. An animation of a trajectory showing the positions of structural water molecules in the vicinity of the C-terminus of vancomycin is also provided.
Table S1. The distances between pairs of hydrogens inferred from NOESY-NMR experiments of monomeric vancomycin, obtained from the simulations, and from the crystal structure 1AA5.
Movie S1. An animation showing the formation of stable networks of structural waters.
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