NMR Restraints Grid
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NMR Restraints Grid |
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Result table
| image | mrblock_id | pdb_id | cing | stage | position | program | type | subtype | subsubtype |
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7910 |
1lae   |
cing | 1-original | 1 | XPLOR/CNS | distance | NOE | ambi |
! Class 1 Distance Restraints
assign ( resid 1 and name H2' )( resid 1 and name H1' ) 3.91 0.83 0.83
assign ( resid 1 and name H2' )( resid 1 and name H6 ) 2.00 0.00 0.32
assign ( resid 1 and name H5 )( resid 1 and name H2' ) 4.33 0.91 0.87
assign (( resid 1 and name H5' ) or ( resid 1 and name H5'' ))
( resid 1 and name H6 ) 4.00 0.50 0.50 ! man
assign ( resid 2 and name H5'' )( resid 1 and name H2'' ) 3.65 1.60 1.55
assign ( resid 2 and name H8 )( resid 1 and name H1' ) 5.54 2.04 -0.33 ! lb-1.0
assign ( resid 2 and name H8 )( resid 1 and name H2' ) 3.17 0.17 0.68 ! ub+0.5
assign ( resid 2 and name H8 )( resid 1 and name H2'' ) 3.00 0.70 0.30 ! lb-0.5
assign ( resid 2 and name H8 )( resid 1 and name H6 ) 4.50 0.50 0.90 ! man
assign ( resid 2 and name H3' )( resid 2 and name H8 ) 4.99 1.05 0.21
assign ( resid 2 and name H4' )( resid 2 and name H8 ) 4.80 0.30 0.30 ! man
assign ( resid 2 and name H5' )( resid 2 and name H8 ) 5.00 0.30 0.30 ! man
assign ( resid 2 and name H8 )( resid 2 and name H1' ) 4.89 1.25 0.31 ! lb-0.5
assign ( resid 2 and name H8 )( resid 2 and name H5'' ) 4.76 1.01 0.44
assign ( resid 3 and name H5 )( resid 2 and name H8 ) 4.36 0.80 0.30 ! lb-0.5
assign ( resid 3 and name H5' )( resid 2 and name H2'' ) 3.32 0.30 0.30
assign ( resid 3 and name H6 )( resid 2 and name H8 ) 5.17 0.66 0.24
assign ( resid 3 and name H2' )( resid 3 and name H1' ) 2.84 0.30 0.30
assign ( resid 3 and name H2' )( resid 3 and name H5 ) 4.14 0.69 0.70
! assign ( resid 3 and name H2'' )( resid 3 and name H5 ) 6.45 0.69 0.69 ! sd
assign ( resid 3 and name H2'' )( resid 3 and name H6 ) 3.55 0.30 0.30
assign ( resid 3 and name H4' )( resid 3 and name H2' ) 3.82 0.30 0.30
assign ( resid 4 and name H5'' )( resid 3 and name H2'' ) 4.09 0.42 0.72 ! ub+0.3
assign ( resid 4 and name H8 )( resid 3 and name H1' ) 3.92 0.32 0.29 ! -1
assign ( resid 4 and name H8 )( resid 3 and name H2' ) 3.12 0.30 0.80 ! ub+0.5
assign ( resid 4 and name H8 )( resid 3 and name H2'' ) 3.04 0.70 0.30 ! lb-0.5
assign ( resid 4 and name H8 )( resid 3 and name H3' ) 4.91 0.56 0.29
assign ( resid 4 and name H8 )( resid 3 and name H6 ) 4.99 0.34 0.51
assign ( resid 4 and name H1' )( resid 4 and name H5' ) 4.80 0.30 0.30 ! man
assign ( resid 4 and name H3' )( resid 4 and name H1' ) 4.13 0.22 0.23
assign ( resid 4 and name H3' )( resid 4 and name H5' ) 3.10 0.30 1.10 ! ub+0.8
assign ( resid 4 and name H3' )( resid 4 and name H8 ) 4.30 0.30 0.30
assign (( resid 4 and name H2' ) or ( resid 4 and name H2'' ))
( resid 4 and name H3' ) 2.31 0.30 0.30
assign ( resid 4 and name H4' )( resid 4 and name H1' ) 3.23 0.30 0.30
assign ( resid 4 and name H4' )( resid 4 and name H3' ) 2.83 0.30 0.30
assign ( resid 4 and name H4' )( resid 4 and name H8 ) 4.80 0.30 0.30 ! man
assign ( resid 4 and name H5'' )( resid 4 and name H3' ) 2.50 0.30 0.30
assign ( resid 4 and name H5'' )( resid 4 and name H8 ) 4.80 0.50 0.50 ! man
assign ( resid 4 and name H8 )( resid 4 and name H1' ) 3.92 0.30 0.30
assign ( resid 4 and name H8 )( resid 4 and name H5' ) 4.82 0.35 0.35
assign (( resid 4 and name H2' ) or ( resid 4 and name H2'' ))
( resid 4 and name H1' ) 2.50 0.30 0.30
assign (( resid 4 and name H2' ) or ( resid 4 and name H2'' ))
( resid 4 and name H5'' ) 5.24 1.17 1.17
assign (( resid 4 and name H2' ) or ( resid 4 and name H2'' ))
( resid 4 and name H8 ) 2.84 0.30 0.30
assign ( resid 5 and name H8 )( resid 4 and name H1' ) 4.16 0.31 0.31
assign ( resid 5 and name H8 )( resid 4 and name H3' ) 4.60 0.30 0.30 ! man
assign ( resid 5 and name H3' )( resid 5 and name H1' ) 3.89 0.47 0.31 ! -1
assign ( resid 5 and name H3' )( resid 5 and name H8 ) 4.79 0.81 0.41
assign ( resid 5 and name H4' )( resid 5 and name H1' ) 3.06 0.30 0.30
assign ( resid 5 and name H4' )( resid 5 and name H8 ) 4.80 0.30 0.30 ! man
assign ( resid 5 and name H5'' )( resid 5 and name H8 ) 5.04 0.72 0.16
assign (( resid 5 and name H2' ) or ( resid 5 and name H2'' ))
( resid 5 and name H1' ) 2.37 0.30 0.30
assign ( resid 5 and name H4' )( resid 6 and name H6 ) 4.49 0.30 0.30
assign ( resid 5 and name H4' )( resid 6 and name H5# ) 3.91 0.60 0.60
assign ( resid 5 and name H5' )( resid 6 and name H5# ) 4.50 0.80 0.80 ! man
assign ( resid 6 and name H2' )( resid 5 and name H1' ) 3.63 0.30 0.30
assign ( resid 6 and name H1' )( resid 6 and name H4' ) 3.64 0.30 0.30
assign ( resid 6 and name H2' )( resid 6 and name H1' ) 3.19 0.30 0.30
assign ( resid 6 and name H2' )( resid 6 and name H4' ) 4.35 0.41 0.41
assign ( resid 6 and name H2'' )( resid 6 and name H1' ) 2.56 0.30 0.30
assign ( resid 6 and name H3' )( resid 6 and name H1' ) 4.33 0.50 0.50 ! -1
assign ( resid 6 and name H3' )( resid 6 and name H2'' ) 2.81 0.30 0.30
assign ( resid 6 and name H3' )( resid 6 and name H4' ) 2.77 0.30 0.30 ! -0.6
assign ( resid 6 and name H5' )( resid 6 and name H6 ) 5.45 1.45 -0.25
assign ( resid 6 and name H6 )( resid 6 and name H1' ) 3.42 0.30 0.30
assign ( resid 6 and name H6 )( resid 6 and name H4' ) 4.78 0.30 0.30
assign ( resid 6 and name H5# )( resid 6 and name H6 ) 2.61 0.30 0.30
assign ( resid 7 and name H8 )( resid 5 and name H1' ) 3.77 0.30 0.30
assign ( resid 7 and name H5' )( resid 6 and name H1' ) 4.31 0.37 0.37
! assign ( resid 7 and name H8 )( resid 6 and name H1' ) 6.41 0.32 0.32 ! sd
assign ( resid 7 and name H8 )( resid 6 and name H3' ) 3.22 0.30 0.30
assign ( resid 7 and name H8 )( resid 6 and name H4' ) 4.38 0.30 0.30
assign ( resid 7 and name H2' )( resid 7 and name H1' ) 2.71 0.72 0.71
assign ( resid 7 and name H3' )( resid 7 and name H2' ) 2.25 0.35 0.35
assign ( resid 7 and name H3' )( resid 7 and name H2'' ) 2.69 0.33 0.33
assign ( resid 7 and name H3' )( resid 7 and name H8 ) 5.20 0.60 0.00
assign ( resid 7 and name H4' )( resid 7 and name H2' ) 4.17 0.79 0.79
assign ( resid 7 and name H4' )( resid 7 and name H3' ) 3.59 1.02 0.52 ! lb-0.5
assign ( resid 7 and name H4' )( resid 7 and name H8 ) 4.90 0.34 0.30
assign ( resid 7 and name H5'' )( resid 7 and name H8 ) 4.84 0.83 0.36
assign ( resid 7 and name H8 )( resid 7 and name H1' ) 3.29 0.31 0.61 ! ub+0.3
! assign ( resid 7 and name H4' )( resid 8 and name H5# ) 7.35 0.48 0.47 ! sd
assign ( resid 8 and name H1' )( resid 7 and name H6A2 ) 4.00 0.50 0.50 !! man***
assign ( resid 8 and name H4' )( resid 7 and name H1' ) 4.90 0.38 0.30
assign ( resid 8 and name H5' )( resid 7 and name H1' ) 2.96 0.36 0.37 ! +1
assign ( resid 8 and name H5' )( resid 7 and name H2'' ) 2.90 0.66 0.66 ! +1
! assign ( resid 8 and name H6 )( resid 7 and name H8 ) 4.60 0.60 0.60 ! man
assign ( resid 8 and name H5# )( resid 7 and name H1' ) 5.88 1.30 -0.68
assign ( resid 8 and name H5# )( resid 7 and name H2' ) 3.67 0.38 0.38
assign ( resid 8 and name H5# )( resid 7 and name H2'' ) 3.02 0.38 0.68 ! ub+0.3
assign ( resid 8 and name H5# )( resid 7 and name H8 ) 5.24 1.02 -0.04 ! lb-0.5
assign ( resid 8 and name H2' )( resid 8 and name H1' ) 2.83 0.30 0.30
assign ( resid 8 and name H2' )( resid 8 and name H6 ) 2.35 0.30 0.30
assign ( resid 8 and name H2' )( resid 8 and name H5# ) 5.39 1.21 -0.19
assign ( resid 8 and name H4' )( resid 8 and name H1' ) 3.09 0.30 0.30
assign ( resid 8 and name H4' )( resid 8 and name H2' ) 4.00 0.46 0.46
assign ( resid 8 and name H4' )( resid 8 and name H2'' ) 3.50 0.39 0.39
assign ( resid 8 and name H4' )( resid 8 and name H6 ) 4.45 0.83 0.75
assign ( resid 8 and name H6 )( resid 8 and name H1' ) 4.56 1.32 0.64
assign ( resid 8 and name H6 )( resid 8 and name H5' ) 2.99 0.41 0.41
assign ( resid 8 and name H5# )( resid 8 and name H6 ) 2.61 0.30 0.30
assign ( resid 8 and name H4' )( resid 9 and name H6 ) 3.30 0.30 0.30
assign ( resid 9 and name H1' )( resid 8 and name H5' ) 2.69 0.29 0.79 ! ub+0.5
assign ( resid 9 and name H2' )( resid 9 and name H6 ) 2.31 0.30 0.30
assign ( resid 9 and name H2'' )( resid 9 and name H6 ) 3.25 0.30 0.60 ! +0.5
assign ( resid 9 and name H3' )( resid 9 and name H6 ) 4.00 0.30 0.30 ! man
assign ( resid 9 and name H4' )( resid 9 and name H1' ) 3.12 0.30 0.30
assign ( resid 9 and name H4' )( resid 9 and name H2' ) 3.46 0.30 0.30
assign ( resid 9 and name H4' )( resid 9 and name H6 ) 4.80 0.30 0.30 ! man
assign ( resid 9 and name H5' )( resid 9 and name H6 ) 4.50 0.50 0.50 ! man
assign ( resid 9 and name H5'' )( resid 9 and name H6 ) 2.85 0.30 0.30
assign ( resid 10 and name H5 )( resid 9 and name H2'' ) 3.28 0.30 0.30
assign ( resid 10 and name H6 )( resid 9 and name H1' ) 3.74 0.30 0.30
assign ( resid 10 and name H6 )( resid 9 and name H2'' ) 2.79 0.30 0.30
assign ( resid 10 and name H6 )( resid 9 and name H6 ) 6.33 1.99 -0.93
assign (( resid 10 and name H5' ) or ( resid 10 and name H5'' ))
( resid 9 and name H1' ) 5.14 0.30 0.30
assign ( resid 10 and name H2' )( resid 10 and name H1' ) 2.95 0.30 0.30
assign ( resid 10 and name H2' )( resid 10 and name H5 ) 5.09 1.62 0.11
assign ( resid 10 and name H2' )( resid 10 and name H6 ) 2.32 0.30 0.30
assign ( resid 10 and name H2'' )( resid 10 and name H1' ) 2.19 0.30 0.30
assign ( resid 10 and name H3' )( resid 10 and name H1' ) 4.18 0.34 0.34
assign ( resid 10 and name H3' )( resid 10 and name H2' ) 2.34 0.30 0.30
assign ( resid 10 and name H3' )( resid 10 and name H2'' ) 2.73 0.30 0.30
assign ( resid 10 and name H3' )( resid 10 and name H6 ) 3.67 0.30 0.30
assign ( resid 10 and name H4' )( resid 10 and name H2' ) 3.56 0.30 0.30
assign ( resid 10 and name H4' )( resid 10 and name H6 ) 4.54 0.30 0.30 ! +0.5
assign ( resid 10 and name H6 )( resid 10 and name H1' ) 3.41 0.30 0.30
assign (( resid 10 and name H5' ) or ( resid 10 and name H5'' ))
( resid 10 and name H2'' ) 4.44 1.04 1.04
assign (( resid 10 and name H5' ) or ( resid 10 and name H5'' ))
( resid 10 and name H6 ) 5.15 0.39 0.39
assign ( resid 11 and name H8 )( resid 10 and name H1' ) 4.03 0.30 0.30
assign ( resid 11 and name H8 )( resid 10 and name H2' ) 3.57 0.30 0.30
assign ( resid 11 and name H8 )( resid 10 and name H2'' ) 2.60 0.30 0.30 ! -0.5
assign ( resid 11 and name H8 )( resid 10 and name H6 ) 4.90 0.30 0.50
assign ( resid 11 and name H3' )( resid 11 and name H8 ) 4.79 0.87 0.41
assign ( resid 11 and name H4' )( resid 11 and name H8 ) 4.50 0.50 0.50 ! man
assign ( resid 11 and name H8 )( resid 11 and name H1' ) 3.89 0.64 0.31 ! -1
assign ( resid 12 and name H5 )( resid 11 and name H8 ) 4.14 0.30 0.30
assign ( resid 12 and name H6 )( resid 11 and name H8 ) 4.82 0.38 0.58
assign ( resid 12 and name H2' )( resid 12 and name H1' ) 3.33 0.36 0.37
assign ( resid 12 and name H2' )( resid 12 and name H5 ) 4.18 0.43 0.43
assign ( resid 12 and name H3' )( resid 12 and name H2'' ) 2.84 0.30 0.30
assign ( resid 12 and name H4' )( resid 12 and name H2' ) 4.04 0.34 0.34
assign ( resid 12 and name H6 )( resid 12 and name H5' ) 4.70 0.62 0.50
assign ( resid 13 and name H8 )( resid 12 and name H1' ) 4.92 0.25 0.25
assign ( resid 13 and name H8 )( resid 12 and name H2' ) 3.38 0.30 0.80 ! ub+0.50
assign ( resid 13 and name H2' )( resid 13 and name H1' ) 3.20 0.30 0.30
assign ( resid 13 and name H3' )( resid 13 and name H8 ) 4.50 0.30 0.30 ! man
assign ( resid 13 and name H4' )( resid 13 and name H1' ) 3.46 0.30 0.30
assign ( resid 13 and name H8 )( resid 13 and name H1' ) 4.86 1.30 0.34 ! lb-0.5
! negative restraints
assign ( resid 8 and name H1' )( resid 9 and name H6 ) 5.00 0.00 10.00
assign ( resid 8 and name H2' )( resid 9 and name H6 ) 5.00 0.00 10.00
assign ( resid 8 and name H2'' )( resid 9 and name H6 ) 5.00 0.00 10.00
assign ( resid 8 and name H3' )( resid 9 and name H6 ) 5.00 0.00 10.00
assign ( resid 8 and name H1' )( resid 9 and name H5 ) 5.00 0.00 10.00
assign ( resid 8 and name H2' )( resid 9 and name H5 ) 5.00 0.00 10.00
assign ( resid 8 and name H2'' )( resid 9 and name H5 ) 5.00 0.00 10.00
! assign ( resid 5 and name H1' )( resid 6 and name H1' ) 6.00 0.00 10.00
assign ( resid 5 and name H1' )( resid 6 and name H5' ) 5.00 0.00 10.00
! assign (( resid 5 and name H2' ) or ( resid 5 and name H2'' ))
! ( resid 6 and name H6 ) 5.00 0.00 10.00
assign (( resid 5 and name H2' ) or ( resid 5 and name H2'' ))
( resid 6 and name H5# ) 5.00 0.00 10.00
assign ( resid 5 and name H1' )( resid 6 and name H5# ) 5.00 0.00 10.00
assign ( resid 5 and name H1' )( resid 7 and name H5' ) 5.00 0.00 10.00
assign ( resid 5 and name H1' )( resid 7 and name H3' ) 5.00 0.00 10.00
assign ( resid 5 and name H1' )( resid 7 and name H2' ) 5.00 0.00 10.00
assign ( resid 5 and name H8 )( resid 7 and name H3' ) 5.00 0.00 10.00
assign ( resid 5 and name H8 )( resid 6 and name H3' ) 5.00 0.00 10.00
Contact the webmaster for help, if required. Thursday, May 2, 2024 1:06:52 PM GMT (wattos1)