Angstat make

angstat_make

Parameters

threshold=real

(default: 0.2)

Description

The angstat make command adds the current structure to the angle statistics that is used to determine redundant dihedral angle restraints in the REDAC strategy (Guntert & Wuthrich, J. Biomol. NMR 1, 447-456, 1991) implemented in the redac macro.

First, the local target function value of every single residue is calculated by summing up all contributions to the target function from restraints that involve that given residue. If a residue and its closest neighbors have a local target function value below the threshold, then all torsion angles of the central residue are added to the angle statistics.

See also

• redac