NMR Restraints Grid

Result table
 (Save to zip file containing files for each block)

image mrblock_id pdb_id bmrb_id cing stage position program type
7512 1kmr 5277 cing 1-original 3 DISCOVER dihedral angle


! Conservation of Peptide bond planarity 
#NMR_dihedral        
1:CYHN_A11:CA 1:CYHN_A11:C 1:ARG+_A12:N 1:ARG+_A12:CA 160 -170 999 999 1000
1:ARG+_A12:CA 1:ARG+_A12:C 1:ALA_A13:N 1:ALA_A13:CA 160 -170 999 999 1000
1:ALA_A13:CA 1:ALA_A13:C 1:LEU_A14:N 1:LEU_A14:CA 160 -170 999 999 1000
1:LEU_A14:CA 1:LEU_A14:C 1:ILE_A15:N 1:ILE_A15:CA 160 -170 999 999 1000
1:ILE_A15:CA 1:ILE_A15:C 1:LYS+_A16:N 1:LYS+_A16:CA 160 -170 999 999 1000
1:LYS+_A16:CA 1:LYS+_A16:C 1:ARG+_A17:N 1:ARG+_A17:CA 160 -170 999 999 1000
1:ARG+_A17:CA 1:ARG+_A17:C 1:ILE_A18:N 1:ILE_A18:CA 160 -170 999 999 1000
1:ILE_A18:CA 1:ILE_A18:C 1:GLN_A19:N 1:GLN_A19:CA 160 -170 999 999 1000
1:GLN_A19:CA 1:GLN_A19:C 1:ALA_A20:N 1:ALA_A20:CA 160 -170 999 999 1000
1:ALA_A20:CA 1:ALA_A20:C 1:MET_A21:N 1:MET_A21:CA 160 -170 999 999 1000
1:MET_A21:CA 1:MET_A21:C 1:ILE_A22:N 1:ILE_A22:CA 160 -170 999 999 1000
1:ILE_A22:CA 1:ILE_A22:C 1:PRO_A23:N 1:PRO_A23:CA 160 -170 999 999 1000
1:PRO_A23:CA 1:PRO_A23:C 1:LYS+_A24:N 1:LYS+_A24:CA 160 -170 999 999 1000
1:LYS+_A24:CA 1:LYS+_A24:C 1:GLYC_A25:N 1:GLYC_A25:CA 160 -170 999 999 1000
!        
! Constrain to alpha helix dihedrals   
! Phi: C'-N-CA-C' ~ -60    
1:ARG+_A12:C 1:ALA_A13:N 1:ALA_A13:CA 1:ALA_A13:C -70 -50 50 50 1000
1:ALA_A13:C 1:LEU_A14:N 1:LEU_A14:CA 1:LEU_A14:C -70 -50 50 50 1000
1:LEU_A14:C 1:ILE_A15:N 1:ILE_A15:CA 1:ILE_A15:C -70 -50 50 50 1000
1:ILE_A15:C 1:LYS+_A16:N 1:LYS+_A16:CA 1:LYS+_A16:C -70 -50 50 50 1000
1:LYS+_A16:C 1:ARG+_A17:N 1:ARG+_A17:CA 1:ARG+_A17:C -70 -50 50 50 1000
1:ARG+_A17:C 1:ILE_A18:N 1:ILE_A18:CA 1:ILE_A18:C -70 -50 50 50 1000
1:ILE_A18:C 1:GLN_A19:N 1:GLN_A19:CA 1:GLN_A19:C -70 -50 50 50 1000
1:GLN_A19:C 1:ALA_A20:N 1:ALA_A20:CA 1:ALA_A20:C -70 -50 50 50 1000
1:ALA_A20:C 1:MET_A21:N 1:MET_A21:CA 1:MET_A21:C -70 -50 50 50 1000
1:MET_A21:C 1:ILE_A22:N 1:ILE_A22:CA 1:ILE_A22:C -70 -50 50 50 1000
! Psi: N-CA-C'-N      
1:ALA_A13:N 1:ALA_A13:CA 1:ALA_A13:C 1:LEU_A14:N -55 -35 50 50 1000
1:LEU_A14:N 1:LEU_A14:CA 1:LEU_A14:C 1:ILE_A15:N -55 -35 50 50 1000
1:ILE_A15:N 1:ILE_A15:CA 1:ILE_A15:C 1:LYS+_A16:N -55 -35 50 50 1000
1:LYS+_A16:N 1:LYS+_A16:CA 1:LYS+_A16:C 1:ARG+_A17:N -55 -35 50 50 1000
1:ARG+_A17:N 1:ARG+_A17:CA 1:ARG+_A17:C 1:ILE_A18:N -55 -35 50 50 1000
1:ILE_A18:N 1:ILE_A18:CA 1:ILE_A18:C 1:GLN_A19:N -55 -35 50 50 1000
1:GLN_A19:N 1:GLN_A19:CA 1:GLN_A19:C 1:ALA_A20:N -55 -35 50 50 1000
1:ALA_A20:N 1:ALA_A20:CA 1:ALA_A20:C 1:MET_A21:N -55 -35 50 50 1000
1:MET_A21:N 1:MET_A21:CA 1:MET_A21:C 1:ILE_A22:N -55 -35 50 50 1000
1:ILE_A22:N 1:ILE_A22:CA 1:ILE_A22:C 1:PRO_A23:N -55 -35 50 50 1000
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