Auto-relaxation and I(0) values: Difference between revisions
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[[CYANA Commands|back to complete commands list]] | |||
The rho files are used to enter auto-relaxation (rho) and I(0) values | The rho files are used to enter auto-relaxation (rho) and I(0) values | ||
into the program CYANA. For each spin there is a | into the program CYANA. For each spin there is a |
Revision as of 10:46, 2 April 2019
back to complete commands list
The rho files are used to enter auto-relaxation (rho) and I(0) values
into the program CYANA. For each spin there is a
line with the following data: residue number, residue name and atom
name, rho (in seconds [s]) and the I(0) value;
the flag -1.0000 is used for keeping the fitted value.
# Specifying both auto-relaxation (rho) and I(0) # Assignment, auto-relaxation, I(0) 5 SER HA 3.7067 752840293.0085 6 LYS HD2 3.5576 1260683444.4590 6 LYS QE 2.6034 2487355750.6458 7 LEU H 5.0151 438936421.8380 7 LEU HA 6.2201 224628629.6022 7 LEU HB2 8.2344 164972110.8104
# Specifying rho only # Assignment, auto-relaxation, I(0)) 5 SER HA 3.7067 -1.0000 6 LYS HD2 3.5576 -1.0000 6 LYS QE 2.6034 -1.0000 7 LEU H 5.0151 -1.0000 7 LEU HA 6.2201 -1.0000 7 LEU HB2 8.2344 -1.0000
# Specifying I(0) only # Assignment, auto-relaxation, I(0) 5 SER HA -1.0000 752840293.0085 6 LYS HD2 -1.0000 1260683444.4590 6 LYS QE -1.0000 2487355750.6458 7 LEU H -1.0000 438936421.8380 7 LEU HA -1.0000 224628629.6022 7 LEU HB2 -1.0000 164972110.8104