NMR Restraints Grid
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NMR Restraints Grid |
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Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
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8769 |
1mv1   |
5588 | cing | 1-original | 3 | DISCOVER | dihedral angle |
! ! DIHEDRAL RESTRAINTS !********************************************** ! ! (From Mark who got them from Chen) ! #NMR_dihedral !alpha P-O5'; first strand ! 1:G5'_1:O3' 1:G_2:P 1:G_2:O5' 1:G_2:C5' -150.000 150.000 50.00 50.00 1000.000 1:G_2:O3' 1:C_3:P 1:C_3:O5' 1:C_3:C5' -150.000 150.000 50.00 50.00 1000.000 1:C_3:O3' 1:PUR_4:P 1:PUR_4:O5' 1:PUR_4:C5' -150.000 150.000 50.00 50.00 1000.000 1:PUR_4:O3' 1:A_5:P 1:A_5:O5' 1:A_5:C5' -150.000 150.000 50.00 50.00 1000.000 1:A_5:O3' 1:G_6:P 1:G_6:O5' 1:G_6:C5' -150.000 150.000 50.00 50.00 1000.000 1:G_6:O3' 1:C_7:P 1:C_7:O5' 1:C_7:C5' -150.000 150.000 50.00 50.00 1000.000 1:C_7:O3' 1:C_8:P 1:C_8:O5' 1:C_8:C5' -150.000 150.000 50.00 50.00 1000.000 1:C_8:O3' 1:U3'_9:P 1:U3'_9:O5' 1:U3'_9:C5' -150.000 150.000 50.00 50.00 1000.000 ! !alpha P-O5'; second strand ! 1:G5'_1B:O3' 1:G_2B:P 1:G_2B:O5' 1:G_2B:C5' -150.000 150.000 50.00 50.00 1000.000 1:G_2B:O3' 1:C_3B:P 1:C_3B:O5' 1:C_3B:C5' -150.000 150.000 50.00 50.00 1000.000 1:C_3B:O3' 1:PUR_4B:P 1:PUR_4B:O5' 1:PUR_4B:C5' -150.000 150.000 50.00 50.00 1000.000 1:PUR_4B:O3' 1:A_5B:P 1:A_5B:O5' 1:A_5B:C5' -150.000 150.000 50.00 50.00 1000.000 1:A_5B:O3' 1:G_6B:P 1:G_6B:O5' 1:G_6B:C5' -150.000 150.000 50.00 50.00 1000.000 1:G_6B:O3' 1:C_7B:P 1:C_7B:O5' 1:C_7B:C5' -150.000 150.000 50.00 50.00 1000.000 1:C_7B:O3' 1:C_8B:P 1:C_8B:O5' 1:C_8B:C5' -150.000 150.000 50.00 50.00 1000.000 1:C_8B:O3' 1:U3'_9B:P 1:U3'_9B:O5' 1:U3'_9B:C5' -150.000 150.000 50.00 50.00 1000.000 ! !beta O5'-C5'; first strand ! ! **********Does not include restraints for A4 & A5********** ! 1:G_2:P 1:G_2:O5' 1:G_2:C5' 1:G_2:C4' 150.000 -150.000 50.00 50.00 1000.000 1:C_3:P 1:C_3:O5' 1:C_3:C5' 1:C_3:C4' 150.000 -150.000 50.00 50.00 1000.000 1:G_6:P 1:G_6:O5' 1:G_6:C5' 1:G_6:C4' 150.000 -150.000 50.00 50.00 1000.000 1:C_7:P 1:C_7:O5' 1:C_7:C5' 1:C_7:C4' 150.000 -150.000 50.00 50.00 1000.000 1:C_8:P 1:C_8:O5' 1:C_8:C5' 1:C_8:C4' 150.000 -150.000 50.00 50.00 1000.000 1:U3'_9:P 1:U3'_9:O5' 1:U3'_9:C5' 1:U3'_9:C4' 150.000 -150.000 50.00 50.00 1000.000 ! !beta O5'-C5'; second strand ! 1:G_2B:P 1:G_2B:O5' 1:G_2B:C5' 1:G_2B:C4' 150.000 -150.000 50.00 50.00 1000.000 1:C_3B:P 1:C_3B:O5' 1:C_3B:C5' 1:C_3B:C4' 150.000 -150.000 50.00 50.00 1000.000 1:G_6B:P 1:G_6B:O5' 1:G_6B:C5' 1:G_6B:C4' 150.000 -150.000 50.00 50.00 1000.000 1:C_7B:P 1:C_7B:O5' 1:C_7B:C5' 1:C_7B:C4' 150.000 -150.000 50.00 50.00 1000.000 1:C_8B:P 1:C_8B:O5' 1:C_8B:C5' 1:C_8B:C4' 150.000 -150.000 50.00 50.00 1000.000 1:U3'_9B:P 1:U3'_9B:O5' 1:U3'_9B:C5' 1:U3'_9B:C4' 150.000 -150.000 50.00 50.00 1000.000 ! !gamma C5'-C4'; first strand ! ! **********Does not include restraints for A4 & A5********** ! 1:G5'_1:O5' 1:G5'_1:C5' 1:G5'_1:C4' 1:G5'_1:C3' 30.000 90.000 50.00 50.00 1000.000 1:G_2:O5' 1:G_2:C5' 1:G_2:C4' 1:G_2:C3' 30.000 90.000 50.00 50.00 1000.000 1:C_3:O5' 1:C_3:C5' 1:C_3:C4' 1:C_3:C3' 30.000 90.000 50.00 50.00 1000.000 1:G_6:O5' 1:G_6:C5' 1:G_6:C4' 1:G_6:C3' 30.000 90.000 50.00 50.00 1000.000 1:C_7:O5' 1:C_7:C5' 1:C_7:C4' 1:C_7:C3' 30.000 90.000 50.00 50.00 1000.000 1:C_8:O5' 1:C_8:C5' 1:C_8:C4' 1:C_8:C3' 30.000 90.000 50.00 50.00 1000.000 1:U3'_9:O5' 1:U3'_9:C5' 1:U3'_9:C4' 1:U3'_9:C3' 30.000 90.000 50.00 50.00 1000.000 ! !gamma C5'-C4'; second strand ! 1:G5'_1B:O5' 1:G5'_1B:C5' 1:G5'_1B:C4' 1:G5'_1B:C3' 30.000 90.000 50.00 50.00 1000.000 1:G_2B:O5' 1:G_2B:C5' 1:G_2B:C4' 1:G_2B:C3' 30.000 90.000 50.00 50.00 1000.000 1:C_3B:O5' 1:C_3B:C5' 1:C_3B:C4' 1:C_3B:C3' 30.000 90.000 50.00 50.00 1000.000 1:G_6B:O5' 1:G_6B:C5' 1:G_6B:C4' 1:G_6B:C3' 30.000 90.000 50.00 50.00 1000.000 1:C_7B:O5' 1:C_7B:C5' 1:C_7B:C4' 1:C_7B:C3' 30.000 90.000 50.00 50.00 1000.000 1:C_8B:O5' 1:C_8B:C5' 1:C_8B:C4' 1:C_8B:C3' 30.000 90.000 50.00 50.00 1000.000 1:U3'_9B:O5' 1:U3'_9B:C5' 1:U3'_9B:C4' 1:U3'_9B:C3' 30.000 90.000 50.00 50.00 1000.000 ! !delta C4'-C3'; first strand ! ! **********Does not include restraints for A4 & A5********** ! 1:G5'_1:C5' 1:G5'_1:C4' 1:G5'_1:C3' 1:G5'_1:O3' 70.000 110.000 50.00 50.00 1000.000 1:G_2:C5' 1:G_2:C4' 1:G_2:C3' 1:G_2:O3' 70.000 110.000 50.00 50.00 1000.000 1:C_3:C5' 1:C_3:C4' 1:C_3:C3' 1:C_3:O3' 70.000 110.000 50.00 50.00 1000.000 1:G_6:C5' 1:G_6:C4' 1:G_6:C3' 1:G_6:O3' 70.000 110.000 50.00 50.00 1000.000 1:C_7:C5' 1:C_7:C4' 1:C_7:C3' 1:C_7:O3' 70.000 110.000 50.00 50.00 1000.000 1:C_8:C5' 1:C_8:C4' 1:C_8:C3' 1:C_8:O3' 70.000 110.000 50.00 50.00 1000.000 1:U3'_9:C5' 1:U3'_9:C4' 1:U3'_9:C3' 1:U3'_9:O3' 70.000 110.000 50.00 50.00 1000.000 ! !delta C4'-C3'; second strand ! 1:G5'_1B:C5' 1:G5'_1B:C4' 1:G5'_1B:C3' 1:G5'_1B:O3' 70.000 110.000 50.00 50.00 1000.000 1:G_2B:C5' 1:G_2B:C4' 1:G_2B:C3' 1:G_2B:O3' 70.000 110.000 50.00 50.00 1000.000 1:C_3B:C5' 1:C_3B:C4' 1:C_3B:C3' 1:C_3B:O3' 70.000 110.000 50.00 50.00 1000.000 1:G_6B:C5' 1:G_6B:C4' 1:G_6B:C3' 1:G_6B:O3' 70.000 110.000 50.00 50.00 1000.000 1:C_7B:C5' 1:C_7B:C4' 1:C_7B:C3' 1:C_7B:O3' 70.000 110.000 50.00 50.00 1000.000 1:C_8B:C5' 1:C_8B:C4' 1:C_8B:C3' 1:C_8B:O3' 70.000 110.000 50.00 50.00 1000.000 1:U3'_9B:C5' 1:U3'_9B:C4' 1:U3'_9B:C3' 1:U3'_9B:O3' 70.000 110.000 50.00 50.00 1000.000 ! !epsilon C3'-O3'; first strand ! ! **********Does not include restraints for A4 & A5********** ! 1:G5'_1:C4' 1:G5'_1:C3' 1:G5'_1:O3' 1:G_2:P -170.000 -100.000 50.00 50.00 1000.000 1:G_2:C4' 1:G_2:C3' 1:G_2:O3' 1:C_3:P -170.000 -100.000 50.00 50.00 1000.000 1:C_3:C4' 1:C_3:C3' 1:C_3:O3' 1:PUR_4:P -170.000 -100.000 50.00 50.00 1000.000 1:G_6:C4' 1:G_6:C3' 1:G_6:O3' 1:C_7:P -170.000 -100.000 50.00 50.00 1000.000 1:C_7:C4' 1:C_7:C3' 1:C_7:O3' 1:C_8:P -170.000 -100.000 50.00 50.00 1000.000 1:C_8:C4' 1:C_8:C3' 1:C_8:O3' 1:U3'_9:P -170.000 -100.000 50.00 50.00 1000.000 ! !epsilon C3'-O3'; second strand ! 1:G5'_1B:C4' 1:G5'_1B:C3' 1:G5'_1B:O3' 1:G_2B:P -170.000 -100.000 50.00 50.00 1000.000 1:G_2B:C4' 1:G_2B:C3' 1:G_2B:O3' 1:C_3B:P -170.000 -100.000 50.00 50.00 1000.000 1:C_3B:C4' 1:C_3B:C3' 1:C_3B:O3' 1:PUR_4B:P -170.000 -100.000 50.00 50.00 1000.000 1:G_6B:C4' 1:G_6B:C3' 1:G_6B:O3' 1:C_7B:P -170.000 -100.000 50.00 50.00 1000.000 1:C_7B:C4' 1:C_7B:C3' 1:C_7B:O3' 1:C_8B:P -170.000 -100.000 50.00 50.00 1000.000 1:C_8B:C4' 1:C_8B:C3' 1:C_8B:O3' 1:U3'_9B:P -170.000 -100.000 50.00 50.00 1000.000 ! !zeta O3'-P; first strand ! ! **********Does not include restraints for A4 & A5********** ! 1:G5'_1:C3' 1:G5'_1:O3' 1:G_2:P 1:G_2:O5' -150.000 150.000 50.00 50.00 1000.000 1:G_2:C3' 1:G_2:O3' 1:C_3:P 1:C_3:O5' -150.000 150.000 50.00 50.00 1000.000 1:G_6:C3' 1:G_6:O3' 1:C_7:P 1:C_7:O5' -150.000 150.000 50.00 50.00 1000.000 1:C_7:C3' 1:C_7:O3' 1:C_8:P 1:C_8:O5' -150.000 150.000 50.00 50.00 1000.000 1:C_8:C3' 1:C_8:O3' 1:U3'_9:P 1:U3'_9:O5' -150.000 150.000 50.00 50.00 1000.000 ! !zeta O3'-P; second strand ! 1:G5'_1B:C3' 1:G5'_1B:O3' 1:G_2B:P 1:G_2B:O5' -150.000 150.000 50.00 50.00 1000.000 1:G_2B:C3' 1:G_2B:O3' 1:C_3B:P 1:C_3B:O5' -150.000 150.000 50.00 50.00 1000.000 1:G_6B:C3' 1:G_6B:O3' 1:C_7B:P 1:C_7B:O5' -150.000 150.000 50.00 50.00 1000.000 1:C_7B:C3' 1:C_7B:O3' 1:C_8B:P 1:C_8B:O5' -150.000 150.000 50.00 50.00 1000.000 1:C_8B:C3' 1:C_8B:O3' 1:U3'_9B:P 1:U3'_9B:O5' -150.000 150.000 50.00 50.00 1000.000 ! !chi Glycosidic torsions; strand 1 ! ! **********Does not include restraints for A4 & A5********** ! 1:G5'_1:O4' 1:G5'_1:C1' 1:G5'_1:N9 1:G5'_1:C4 150.000 -150.000 50.00 50.00 1000.000 1:G_2:O4' 1:G_2:C1' 1:G_2:N9 1:G_2:C4 150.000 -150.000 50.00 50.00 1000.000 1:C_3:O4' 1:C_3:C1' 1:C_3:N1 1:C_3:C2 150.000 -150.000 50.00 50.00 1000.000 1:G_6:O4' 1:G_6:C1' 1:G_6:N9 1:G_6:C4 150.000 -150.000 50.00 50.00 1000.000 1:C_7:O4' 1:C_7:C1' 1:C_7:N1 1:C_7:C2 150.000 -150.000 50.00 50.00 1000.000 1:C_8:O4' 1:C_8:C1' 1:C_8:N1 1:C_8:C2 150.000 -150.000 50.00 50.00 1000.000 1:U3'_9:O4' 1:U3'_9:C1' 1:U3'_9:N1 1:U3'_9:C2 150.000 -150.000 50.00 50.00 1000.000 ! !chi Glycosidic torsions; strand 2 ! 1:G5'_1B:O4' 1:G5'_1B:C1' 1:G5'_1B:N9 1:G5'_1B:C4 150.000 -150.000 50.00 50.00 1000.000 1:G_2B:O4' 1:G_2B:C1' 1:G_2B:N9 1:G_2B:C4 150.000 -150.000 50.00 50.00 1000.000 1:C_3B:O4' 1:C_3B:C1' 1:C_3B:N1 1:C_3B:C2 150.000 -150.000 50.00 50.00 1000.000 1:G_6B:O4' 1:G_6B:C1' 1:G_6B:N9 1:G_6B:C4 150.000 -150.000 50.00 50.00 1000.000 1:C_7B:O4' 1:C_7B:C1' 1:C_7B:N1 1:C_7B:C2 150.000 -150.000 50.00 50.00 1000.000 1:C_8B:O4' 1:C_8B:C1' 1:C_8B:N1 1:C_8B:C2 150.000 -150.000 50.00 50.00 1000.000 1:U3'_9B:O4' 1:U3'_9B:C1' 1:U3'_9B:N1 1:U3'_9B:C2 150.000 -150.000 50.00 50.00 1000.000
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