Skip to main content

Science Gateways will have scheduled maintenance work on Tuesday, June 25, 2024. The platform will operate normally for most of the day, except for a 2-4 hour outage period. Please plan accordingly and we do apologize for any inconvenience.

CS ROSETTA3

Licensed according to this deed.

Published on

Abstract

CS ROSETTA is a protocol which generates 3D models of proteins, using only the 13CA, 13CB, 13C', 15N, 1HA and 1HN NMR chemical shifts as input. Based on these parameters, CS ROSETTA uses a SPARTA-based selection procedure to select a set of fragments from a fragment-library (where the chemical shifts and the 3D structure of the fragments are known). The fragments are assembled using the ROSETTA protocol. The generated models are rescored based on the difference between the back-calculated chemical shifts of the generated models and the input chemical shifts.

Citation

van der Schot et al., Improving 3D structure prediction from chemical shift data. J. Biomol. NMR., 57, 27-35 (2013)

Site

Documents

Software

Users

cyoun, sg_admin

Cite this work

Researchers should cite this work as follows:

  • (2024), "CS ROSETTA3," https://sciencegateways.org/resources/csrosetta3.

    BibTex | EndNote

Tags