NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
|
|
25634 |
2kam   |
16028 | cing | 1-original | 2 | XPLOR/CNS | dihedral angle |
! 3-bond J-coupling data non-gly residues
! based on tabela 3-d tese Lic. Carla
! determinado by the method of Kim-Prestgard
! were converted to dihedrals
! if J3 Hn-Ha < 6 and in helical region:
assign (resid 1 and name c ) (resid 2 and name n )
(resid 2 and name ca) (resid 2 and name c ) 1 -60.0 30.0 2
assign (resid 2 and name c ) (resid 3 and name n )
(resid 3 and name ca) (resid 3 and name c ) 1 -60.0 30.0 2
assign (resid 3 and name c ) (resid 4 and name n )
(resid 4 and name ca) (resid 4 and name c ) 1 -60.0 30.0 2
assign (resid 4 and name c ) (resid 5 and name n )
(resid 5 and name ca) (resid 5 and name c ) 1 -60.0 30.0 2
assign (resid 5 and name c ) (resid 6 and name n )
(resid 6 and name ca) (resid 6 and name c ) 1 -60.0 30.0 2
assign (resid 6 and name c ) (resid 7 and name n )
(resid 7 and name ca) (resid 7 and name c ) 1 -60.0 30.0 2
assign (resid 7 and name c ) (resid 8 and name n )
(resid 8 and name ca) (resid 8 and name c ) 1 -60.0 30.0 2
assign (resid 8 and name c ) (resid 9 and name n )
(resid 9 and name ca) (resid 9 and name c ) 1 -60.0 30.0 2
! Gly10
assign (resid 10 and name c ) (resid 11 and name n )
(resid 11 and name ca) (resid 11 and name c ) 1 -60.0 30.0 2
assign (resid 11 and name c ) (resid 12 and name n )
(resid 12 and name ca) (resid 12 and name c ) 1 -60.0 30.0 2
assign (resid 12 and name c ) (resid 13 and name n )
(resid 13 and name ca) (resid 13 and name c ) 1 -60.0 30.0 2
assign (resid 13 and name c ) (resid 14 and name n )
(resid 14 and name ca) (resid 14 and name c ) 1 -60.0 30.0 2
assign (resid 14 and name c ) (resid 15 and name n )
(resid 15 and name ca) (resid 15 and name c ) 1 -60.0 30.0 2
assign (resid 15 and name c ) (resid 16 and name n )
(resid 16 and name ca) (resid 16 and name c ) 1 -60.0 30.0 2
assign (resid 16 and name c ) (resid 17 and name n )
(resid 17 and name ca) (resid 17 and name c ) 1 -60.0 30.0 2
assign (resid 17 and name c ) (resid 18 and name n )
(resid 18 and name ca) (resid 18 and name c ) 1 -60.0 30.0 2
assign (resid 18 and name c ) (resid 19 and name n )
(resid 19 and name ca) (resid 19 and name c ) 1 -60.0 30.0 2
assign (resid 19 and name c ) (resid 20 and name n )
(resid 20 and name ca) (resid 20 and name c ) 1 -60.0 30.0 2
assign (resid 20 and name c ) (resid 21 and name n )
(resid 21 and name ca) (resid 21 and name c ) 1 -60.0 30.0 2
assign (resid 21 and name c ) (resid 22 and name n )
(resid 22 and name ca) (resid 22 and name c ) 1 -60.0 30.0 2
! Values < 7.5 but not helix.
! assign (resid 22 and name c ) (resid 23 and name n )
! (resid 23 and name ca) (resid 23 and name c ) 1 60.0 150.0 2
! assign (resid 23 and name c ) (resid 24 and name n )
! (resid 24 and name ca) (resid 24 and name c ) 1 60.0 150.0 2
! assign (resid 24 and name c ) (resid 25 and name n )
! (resid 25 and name ca) (resid 25 and name c ) 1 60.0 150.0 2
! assign (resid 25 and name c ) (resid 26 and name n )
! (resid 26 and name ca) (resid 26 and name c ) 1 60.0 150.0 2
!## chi1 dihedrals for Val residues
!! Val 13
assign (resid 13 and name n) (resid 13 and name ca)
(resid 13 and name cb) (resid 13 and name cg1) 1.0 180.0 30.0 2
!! Val 20
assign (resid 20 and name n) (resid 13 and name ca)
(resid 20 and name cb) (resid 13 and name cg1) 1.0 180.0 30.0 2
Contact the webmaster for help, if required. Saturday, June 1, 2024 1:04:44 AM GMT (wattos1)