Ruthenium Agostic (Phosphinoaryl)borane Complexes: Multinuclear Solid-State and Solution NMR, X-ray, and DFT Studies

		BioNMR > Educational resources > Journal club
Ruthenium Agostic (Phosphinoaryl)borane Complexes: Multinuclear Solid-State and Solution NMR, X-ray, and DFT Studies

Webservers

NMR processing:

MDD

NMR assignment:

Backbone:

Side-chains:

NOEs:

Structure from NMR restraints:

Ab initio:

Fragment-based:

Rosetta-NMR (Robetta)

Template-based:

GeNMR

I-TASSER

Refinement:

Amber

Structure from chemical shifts:

Fragment-based:

Homology-based:

Torsion angles from chemical shifts:

Preditor

TALOS

Promega- Proline

Secondary structure from chemical shifts:

CSI (via RCI server)

TALOS

MICS caps, β-turns

d2D

PECAN

Flexibility from chemical shifts:

RCI

Interactions from chemical shifts:

HADDOCK

Chemical shifts re-referencing:

NMR model quality:

NOEs, other restraints:

Chemical shifts:

RDCs:

Pseudocontact shifts:

Protein geomtery:

SAVES2 or SAVES4

Quality Control Check

NMR spectrum prediction:

FANDAS

MestReS

V-NMR

Flexibility from structure:

Backbone S2

Methyl S2

B-factor

Molecular dynamics:

Gromacs

Amber

Antechamber

Chemical shifts prediction:

From structure:

Shiftx2

Sparta+

Camshift

CH3shift- Methyl

ArShift- Aromatic

ShiftS

Proshift

PPM

CheShift-2- Cα

From sequence:

Shifty

Camcoil

Poulsen_rc_CS

Disordered proteins:

MAXOCC

Format conversion & validation:

CCPN

From NMR-STAR 3.1

Validate NMR-STAR 3.1

NMR sample preparation:

Protein disorder:

DisMeta

Protein solubility:

Isotope labeling:

Solid-state NMR:

Thread Tools

Search this Thread

Rate Thread

Display Modes

10-11-2011, 06:32 AM

nmrlearner

Senior Member

Join Date: Jan 2005

Posts: 23,732

Points: 193,617, Level: 100

Level up: 0%, 0 Points needed

Activity: 50.7%

Last Achievements

Award-Showcase

NMR Credits: 0

NMR Points: 193,617

Downloads: 0

Uploads: 0

Ruthenium Agostic (Phosphinoaryl)borane Complexes: Multinuclear Solid-State and Solution NMR, X-ray, and DFT Studies

Ruthenium Agostic (Phosphinoaryl)borane Complexes: Multinuclear Solid-State and Solution NMR, X-ray, and DFT Studies

Yann Gloaguen, Gilles Alcaraz, Alban S. Petit, Eric Clot, Yannick Coppel, Laure Vendier and Sylviane Sabo-Etienne

Journal of the American Chemical Society
DOI: 10.1021/ja203828r

Source: Journal of the American Chemical Society

Did you find this post helpful?

Similar Threads
Thread	Thread Starter	Forum	Replies	Last Post
[NMR tweet] Multinuclear Solid-State Nuclear Magnetic Resonance of Inorganic Materials, Volume 6 (Pergamon Materials Series): http://amzn.to/kSPkSn Multinuclear Solid-State Nuclear Magnetic Resonance of Inorganic Materials, Volume 6 (Pergamon Materials Series): http://amzn.to/kSPkSn Published by Carolazkl (Carola Dundlow) on 2011-05-22T01:28:17Z Source: Twitter	nmrlearner	Twitter NMR	0	05-22-2011 01:54 AM
[NMR tweet] Multinuclear Solid-State Nuclear Magnetic Resonance of Inorganic Materials, Volume 6 (Pergamon Materials Series): http://amzn.to/kSPkSn Multinuclear Solid-State Nuclear Magnetic Resonance of Inorganic Materials, Volume 6 (Pergamon Materials Series): http://amzn.to/kSPkSn Published by Lucilleqzkw (Lucille Guardiola) on 2011-05-18T09:25:57Z Source: Twitter	nmrlearner	Twitter NMR	0	05-18-2011 09:27 AM
[NMR tweet] Multinuclear Solid-State Nuclear Magnetic Resonance of Inorganic Materials, Volume 6 (Pergamon Materials Series): http://amzn.to/ewA2OW Multinuclear Solid-State Nuclear Magnetic Resonance of Inorganic Materials, Volume 6 (Pergamon Materials Series): http://amzn.to/ewA2OW Published by Simonago63 (Simona Likes) on 2011-04-25T19:18:52Z Source: Twitter	nmrlearner	Twitter NMR	0	04-25-2011 07:21 PM
[NMR tweet] Multinuclear Solid-State Nuclear Magnetic Resonance of Inorganic Materials: Multinuclear? http://goo.gl/fb/bqdBo Multinuclear Solid-State Nuclear Magnetic Resonance of Inorganic Materials: Multinuclear? http://goo.gl/fb/bqdBo Published by ebooksfreedl (ebooksfreedownload) on 2011-03-15T22:11:35Z Source: Twitter	nmrlearner	Twitter NMR	0	03-15-2011 10:34 PM
Solution- and solid-state NMR studies of GPCRs and their ligands (Review). Solution- and solid-state NMR studies of GPCRs and their ligands (Review). Related Articles Solution- and solid-state NMR studies of GPCRs and their ligands (Review). Biochim Biophys Acta. 2010 Oct 14; Authors: Tapaneeyakorn S, Goddard AD, Oates J, Willis CL, Watts A G protein-coupled receptors (GPCRs) represent one of the major targets of new drugs on the market given their roles as key membrane receptors in many cellular signalling pathways. Structure-based drug design has potential to be the most reliable method for novel drug discovery....	nmrlearner	Journal club	0	10-19-2010 04:51 PM
[NMR tweet] [science] Multinuclear Solid-State Nuclear Magnetic Resonance of Inorganic Materials, Multinuclear Solid-State Nuclear Magnetic Resonance of Inorganic Materials, Volume 6: Publisher: Pergamo... http://bit.ly/cpj98d Published by ebook30 (EBOOK30.com) on 2010-10-06T15:08:51Z Source: Twitter	nmrlearner	Twitter NMR	0	10-06-2010 03:27 PM
[NMR tweet] #ebook Multinuclear Solid-State Nuclear Magnetic Resonance of Inorganic Materials, Vo #ebook Multinuclear Solid-State Nuclear Magnetic Resonance of Inorganic Materials, Volume 6: Publisher: Pergamon 2... http://bit.ly/cBlkGq Published by agungabb (agungabb) on 2010-10-06T15:05:40Z Source: Twitter	nmrlearner	Twitter NMR	0	10-06-2010 03:27 PM
[NMR tweet] Multinuclear Solid-State Nuclear Magnetic Resonance of Inorganic Materials, Volume 6: Multinuclear Solid-State Nuclear Magnetic Resonance of Inorganic Materials, Volume 6: Multinuclear Solid-State Nuc... http://bit.ly/b26M2S Published by Perepelkin_I_G (Igor Perepelkin) on 2010-10-06T08:45:37Z Source: Twitter	nmrlearner	Twitter NMR	0	10-06-2010 08:50 AM

« Previous Thread | Next Thread »

Posting Rules
You may not post new threads You may not post replies You may not post attachments You may not edit your posts BB code is On Smilies are On [IMG] code is On HTML code is On Trackbacks are Off Pingbacks are Off Refbacks are Off