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
550099 2lua 18514 cing 1-original 3 unknown unknown


presidue cysdh                
    delete    atom 1HG               end
    modify    atom 1CB  charge= 0.00 end
    modify    atom 1SG  charge= 0.00 end
end

presidue zf
    add bond 1SG 5ZN
    add bond 2SG 5ZN
    add bond 3SG 5ZN
    add bond 4SG 5ZN
    
    add angle 1SG 5ZN 2SG
    add angle 1SG 5ZN 3SG
    add angle 1SG 5ZN 4SG
    add angle 2SG 5ZN 3SG
    add angle 2SG 5ZN 4SG
    add angle 3SG 5ZN 4SG

!    add angle 1CB 1SG 5ZN
!    add angle 2CB 2SG 5ZN
!    add angle 3CB 2SG 5ZN
!    add angle 4CB 2SG 5ZN

end

bond SH1E ZN 1000.000 {sd=     0.001} 2.30
!angle CH2E SH1E ZN 500.00 {sd=     0.031} 109.5
angle SH1E ZN SH1E 500.00 {sd=     0.031} 109.5




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