[ASAP] Hydride-Containing Eight-Electron Pt/Ag Superatoms: Structure, Bonding, and Multi-NMR Studies

		BioNMR > Educational resources > Journal club
[ASAP] Hydride-Containing Eight-Electron Pt/Ag Superatoms: Structure, Bonding, and Multi-NMR 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

06-03-2022, 07:40 PM

nmrlearner

Senior Member

Join Date: Jan 2005

Posts: 23,777

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

[ASAP] Hydride-Containing Eight-Electron Pt/Ag Superatoms: Structure, Bonding, and Multi-NMR Studies

[ASAP] Hydride-Containing Eight-Electron Pt/Ag Superatoms: Structure, Bonding, and Multi-NMR Studies

Tzu-Hao Chiu, Jian-Hong Liao, Franck Gam, Ying-Yann Wu, Xiaoping Wang, Samia Kahlal, Jean-Yves Saillard, and C. W. Liu

Journal of the American Chemical Society
DOI: 10.1021/jacs.2c03715

Source: Journal of the American Chemical Society

Did you find this post helpful?

Similar Threads
Thread	Thread Starter	Forum	Replies	Last Post
[ASAP] Constraints on the Structure of Fibrils Formed by a Racemic Mixture of Amyloid-? Peptides from Solid-State NMR, Electron Microscopy, and Theory Constraints on the Structure of Fibrils Formed by a Racemic Mixture of Amyloid-? Peptides from Solid-State NMR, Electron Microscopy, and Theory Jevgenij A. Raskatov, Alejandro R. Foley, John M. Louis, Wai-Ming Yau, and Robert Tycko https://pubs.acs.org/na101/home/literatum/publisher/achs/journals/content/jacsat/0/jacsat.ahead-of-print/jacs.1c06339/20210810/images/medium/ja1c06339_0009.gif Journal of the American Chemical Society DOI: 10.1021/jacs.1c06339 http://feeds.feedburner.com/~r/acs/jacsat/~4/icEctWA9HQc	nmrlearner	Journal club	0	08-11-2021 07:41 PM
[ASAP] Coupled In Situ NMR and EPR Studies Reveal the Electron Transfer Rate and Electrolyte Decomposition in Redox Flow Batteries Coupled In Situ NMR and EPR Studies Reveal the Electron Transfer Rate and Electrolyte Decomposition in Redox Flow Batteries Evan Wenbo Zhao, Erlendur Jo?nsson, Rajesh B. Jethwa, Dominic Hey, Dongxun Lyu, Adam Brookfield, Peter A. A. Klusener, David Collison, and Clare P. Grey https://pubs.acs.org/na101/home/literatum/publisher/achs/journals/content/jacsat/0/jacsat.ahead-of-print/jacs.0c10650/20210121/images/medium/ja0c10650_0008.gif Journal of the American Chemical Society DOI: 10.1021/jacs.0c10650 http://feeds.feedburner.com/~r/acs/jacsat/~4/AFpRBY2VIIc	nmrlearner	Journal club	0	01-22-2021 10:13 AM
[ASAP] In vitro-Constructed Ribosomes Enable Multi-site Incorporation of Noncanonical Amino Acids into Proteins In vitro-Constructed Ribosomes Enable Multi-site Incorporation of Noncanonical Amino Acids into Proteins https://pubs.acs.org/na101/home/literatum/publisher/achs/journals/content/bichaw/0/bichaw.ahead-of-print/acs.biochem.0c00829/20210111/images/medium/bi0c00829_0006.gif Biochemistry DOI: 10.1021/acs.biochem.0c00829 http://feeds.feedburner.com/~r/acs/bichaw/~4/ka6wq8GcKfY More...	nmrlearner	Journal club	0	01-13-2021 08:38 AM
[ASAP] A Nuclear Resonance Vibrational Spectroscopic Study of Oxy Myoglobins Reconstituted with Chemically Modified Heme Cofactors: Insights into the Fe–O2 Bonding and Internal Dynamics of the Protein A Nuclear Resonance Vibrational Spectroscopic Study of Oxy Myoglobins Reconstituted with Chemically Modified Heme Cofactors: Insights into the Fe–O2 Bonding and Internal Dynamics of the Protein https://pubs.acs.org/appl/literatum/publisher/achs/journals/content/bichaw/0/bichaw.ahead-of-print/acs.biochem.8b00829/20181119/images/medium/bi-2018-00829h_0005.gif Biochemistry DOI: 10.1021/acs.biochem.8b00829 http://feeds.feedburner.com/~ff/acs/bichaw?d=yIl2AUoC8zA http://feeds.feedburner.com/~r/acs/bichaw/~4/8rdOmUxjIuA More...	nmrlearner	Journal club	0	11-25-2018 06:02 AM
[ASAP] X-ray Emission Spectroscopy as an in Situ Diagnostic Tool for X-ray Crystallography of Metalloproteins Using an X-ray Free-Electron Laser X-ray Emission Spectroscopy as an in Situ Diagnostic Tool for X-ray Crystallography of Metalloproteins Using an X-ray Free-Electron Laser https://pubs.acs.org/appl/literatum/publisher/achs/journals/content/bichaw/0/bichaw.ahead-of-print/acs.biochem.8b00325/20180628/images/medium/bi-2018-00325f_0007.gif Biochemistry DOI: 10.1021/acs.biochem.8b00325 http://feeds.feedburner.com/~ff/acs/bichaw?d=yIl2AUoC8zA http://feeds.feedburner.com/~r/acs/bichaw/~4/h0rNnSSvyKY More...	nmrlearner	Journal club	0	06-29-2018 08:31 AM
[NMR paper] Indirect use of deuterium in solution NMR studies of protein structure and hydrogen bonding. Indirect use of deuterium in solution NMR studies of protein structure and hydrogen bonding. Related Articles Indirect use of deuterium in solution NMR studies of protein structure and hydrogen bonding. Prog Nucl Magn Reson Spectrosc. 2014 Feb;77:49-68 Authors: Tugarinov V Abstract A description of the utility of deuteration in protein NMR is provided with an emphasis on quantitative evaluation of the effects of deuteration on a number of NMR parameters of proteins: (1) chemical shifts, (2) scalar coupling constants, (3) relaxation...	nmrlearner	Journal club	0	01-15-2014 05:16 PM
Indirect Use of Deuterium in Solution NMR Studies of Protein Structure and Hydrogen Bonding Indirect Use of Deuterium in Solution NMR Studies of Protein Structure and Hydrogen Bonding Publication date: Available online 28 August 2013 Source:Progress in Nuclear Magnetic Resonance Spectroscopy</br> Author(s): Vitali Tugarinov</br> A description of the utility of deuteration in protein NMR is provided with an emphasis on quantitative evaluation of the effects of deuteration on a number of NMR parameters of proteins: (1) chemical shifts, (2) scalar coupling constants, (3) relaxation properties (R 1 and R 2 rates) of nuclei directly attached to one or more...	nmrlearner	Journal club	0	08-29-2013 01:27 AM
Hydrogen-bonding potential to refine NMR structure An Empirical Backbone-Backbone Hydrogen-Bonding Potential in Proteins and Its Applications to NMR Structure Refinement and Validation Alexander Grishaev and Ad Bax J. Am. Chem. Soc.; 2004; 126(23) pp 7281 - 7292 http://pubs.acs.org./isubscribe/journals/jacsat/126/i23/figures/ja0319994n00001.gif Abstract: A new multidimensional potential is described that encodes for the relative spatial arrangement of the peptidyl backbone units as observed within a large database of high-resolution X-ray structures. The detailed description afforded by such an analysis provides an opportunity to study...	nmrlearner	Journal club	0	06-29-2005 04:16 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