posted on 2022-03-17, 03:47authored byDavid WinklerDavid Winkler, Aaron Thornton, Ira Katz, Geraldine Farjot
The files contain the PDB IDs for proteins and the cartesian coordinates of noble gases bound to them, in the same coordinate system as the parent PDB file. The binding energies are also provided. Two types of file are provided for each noble gas, one set for proteins that have endogenous or exogenous ligands in the structures, and those that do not.
History
School
School of Molecular Sciences
Publication Date
2021-01-01
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