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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497571 |
2krl   |
cing | 1-original | 3 | XPLOR/CNS | distance | hydrogen bond | simple |
!======================================================================= ! Hydrogn bonding restraints !======================================================================= !# duplex #1: ! ! Gua 1 -- Uri 20 * standard anti-anti G-U wobble pair assign (resid 1 and name O6 ) (resid 20 and name H3 ) 2.00 0.2 4.2 assign (resid 1 and name O6 ) (resid 20 and name N3 ) 2.90 0.3 3.3 assign (resid 1 and name H1 ) (resid 20 and name O2 ) 2.00 0.2 4.2 assign (resid 1 and name N1 ) (resid 20 and name O2 ) 2.90 0.3 3.3 ! ! Gua 2 -- Cyt 19 assign (resid 2 and name O6 ) (resid 19 and name N4 ) 2.90 0.3 0.3 assign (resid 2 and name H1 ) (resid 19 and name N3 ) 2.00 0.2 0.2 assign (resid 2 and name N1 ) (resid 19 and name N3 ) 2.90 0.3 0.3 assign (resid 2 and name H21) (resid 19 and name O2 ) 2.00 0.2 0.2 assign (resid 2 and name N2 ) (resid 19 and name O2 ) 2.90 0.3 0.3 ! ! Ade 3 -- Uri 18 assign (resid 3 and name H61) (resid 18 and name O4 ) 2.00 0.2 0.2 assign (resid 3 and name N6 ) (resid 18 and name O4 ) 2.90 0.3 0.3 assign (resid 3 and name N1 ) (resid 18 and name H3 ) 2.00 0.2 0.2 assign (resid 3 and name N1 ) (resid 18 and name N3 ) 2.90 0.3 0.3 ! ! Gua 17 -- Cyt 4 assign (resid 17 and name O6 ) (resid 4 and name H41) 2.00 0.2 0.2 assign (resid 17 and name O6 ) (resid 4 and name N4 ) 2.90 0.3 0.3 assign (resid 17 and name H1 ) (resid 4 and name N3 ) 2.00 0.2 0.2 assign (resid 17 and name N1 ) (resid 4 and name N3 ) 2.90 0.3 0.3 assign (resid 17 and name H21) (resid 4 and name O2 ) 2.00 0.2 0.2 assign (resid 17 and name N2 ) (resid 4 and name O2 ) 2.90 0.3 0.3 ! ! Gua 5 -- Uri 16 * standard anti-anti G-U wobble pair assign (resid 5 and name O6 ) (resid 16 and name H3 ) 2.00 0.2 0.2 assign (resid 5 and name O6 ) (resid 16 and name N3 ) 2.90 0.3 0.3 assign (resid 5 and name H1 ) (resid 16 and name O2 ) 2.00 0.2 0.2 assign (resid 5 and name N1 ) (resid 16 and name O2 ) 2.90 0.3 0.3 ! ! Gua 6 -- Cyt 15 assign (resid 6 and name O6 ) (resid 15 and name H41) 2.00 0.2 0.2 assign (resid 6 and name O6 ) (resid 15 and name N4 ) 2.90 0.3 0.3 assign (resid 6 and name H1 ) (resid 15 and name N3 ) 2.00 0.2 0.2 assign (resid 6 and name N1 ) (resid 15 and name N3 ) 2.90 0.3 0.3 assign (resid 6 and name H21) (resid 15 and name O2 ) 2.00 0.2 0.2 assign (resid 6 and name N2 ) (resid 15 and name O2 ) 2.90 0.3 0.3 ! ! Ade 14 -- Uri 7 assign (resid 14 and name H61) (resid 7 and name O4 ) 2.00 0.2 6.0 assign (resid 14 and name N6 ) (resid 7 and name O4 ) 2.90 0.3 6.0 assign (resid 14 and name N1 ) (resid 7 and name N3 ) 2.90 0.3 0.3 ! ! Gua 8 -- Cyt 13 assign (resid 8 and name O6 ) (resid 13 and name H41) 2.00 0.2 0.2 assign (resid 8 and name O6 ) (resid 13 and name N4 ) 2.90 0.3 0.3 assign (resid 8 and name H1 ) (resid 13 and name N3 ) 2.00 0.2 0.2 assign (resid 8 and name N1 ) (resid 13 and name N3 ) 2.90 0.3 0.3 assign (resid 8 and name H21) (resid 13 and name O2 ) 2.00 0.2 0.2 assign (resid 8 and name N2 ) (resid 13 and name O2 ) 2.90 0.3 0.3 !# duplex #2: ! ! Gua 27 -- Cyt 53 assign (resid 27 and name O6 ) (resid 53 and name H41) 2.00 0.2 0.2 assign (resid 27 and name O6 ) (resid 53 and name N4 ) 2.90 0.3 0.3 assign (resid 27 and name H1 ) (resid 53 and name N3 ) 2.00 0.2 0.2 assign (resid 27 and name N1 ) (resid 53 and name N3 ) 2.90 0.3 0.3 assign (resid 27 and name H21) (resid 53 and name O2 ) 2.00 0.2 0.2 assign (resid 27 and name N2 ) (resid 53 and name O2 ) 2.90 0.3 0.3 ! ! Gua 28 -- Uri 52 * standard anti-anti G-U wobble pair assign (resid 28 and name O6 ) (resid 52 and name H3 ) 2.00 0.2 0.2 assign (resid 28 and name O6 ) (resid 52 and name N3 ) 2.90 0.3 0.3 assign (resid 28 and name H1 ) (resid 52 and name O2 ) 2.00 0.2 0.2 assign (resid 28 and name N1 ) (resid 52 and name O2 ) 2.90 0.3 0.3 ! ! Gua 29 -- Cyt 51 assign (resid 29 and name O6 ) (resid 51 and name N4 ) 2.90 0.3 0.3 assign (resid 29 and name H1 ) (resid 51 and name N3 ) 2.00 0.2 0.2 assign (resid 29 and name N1 ) (resid 51 and name N3 ) 2.90 0.3 0.3 assign (resid 29 and name H21) (resid 51 and name O2 ) 2.00 0.2 0.2 assign (resid 29 and name N2 ) (resid 51 and name O2 ) 2.90 0.3 0.3 ! ! Gua 50 -- Cyt 30 assign (resid 50 and name O6 ) (resid 30 and name H41) 2.00 0.2 0.2 assign (resid 50 and name O6 ) (resid 30 and name N4 ) 2.90 0.3 0.3 assign (resid 50 and name H1 ) (resid 30 and name N3 ) 2.00 0.2 0.2 assign (resid 50 and name N1 ) (resid 30 and name N3 ) 2.90 0.3 0.3 assign (resid 50 and name H21) (resid 30 and name O2 ) 2.00 0.2 0.2 assign (resid 50 and name N2 ) (resid 30 and name O2 ) 2.90 0.3 0.3 ! ! Ade 31 -- Uri 49 assign (resid 31 and name N1 ) (resid 49 and name H3 ) 2.00 0.2 0.2 assign (resid 31 and name N1 ) (resid 49 and name N3 ) 2.90 0.3 0.3 ! ! Gua 48 -- Uri 32 * standard anti-anti G-U wobble pair assign (resid 48 and name O6 ) (resid 32 and name H3 ) 2.00 0.2 0.2 assign (resid 48 and name O6 ) (resid 32 and name N3 ) 2.90 0.3 0.3 assign (resid 48 and name H1 ) (resid 32 and name O2 ) 2.00 0.2 0.2 assign (resid 48 and name N1 ) (resid 32 and name O2 ) 2.90 0.3 0.3 ! ! Ade 47 -- Uri 33 assign (resid 47 and name H61) (resid 33 and name O4 ) 2.00 0.2 0.2 assign (resid 47 and name N6 ) (resid 33 and name O4 ) 2.90 0.3 0.3 assign (resid 47 and name N1 ) (resid 33 and name H3 ) 2.00 0.2 0.2 assign (resid 47 and name N1 ) (resid 33 and name N3 ) 2.90 0.3 0.3 ! ! Ade 34 -- Uri 46 assign (resid 34 and name H61) (resid 46 and name O4 ) 2.00 0.2 0.2 assign (resid 34 and name N6 ) (resid 46 and name O4 ) 2.90 0.3 0.3 assign (resid 34 and name N1 ) (resid 46 and name H3 ) 2.00 0.2 0.2 assign (resid 34 and name N1 ) (resid 46 and name N3 ) 2.90 0.3 0.3 !# duplex #3 ! ! Gua 57 -- Cyt 98 assign (resid 57 and name O6 ) (resid 98 and name H41) 2.00 0.2 0.2 assign (resid 57 and name O6 ) (resid 98 and name N4 ) 2.90 0.3 0.3 assign (resid 57 and name H1 ) (resid 98 and name N3 ) 2.00 0.2 0.2 assign (resid 57 and name N1 ) (resid 98 and name N3 ) 2.90 0.3 0.3 assign (resid 57 and name H21) (resid 98 and name O2 ) 2.00 0.2 0.2 assign (resid 57 and name N2 ) (resid 98 and name O2 ) 2.90 0.3 0.3 ! ! Gua 58 -- Cyt 97 assign (resid 58 and name O6 ) (resid 97 and name H41) 2.00 0.2 0.2 assign (resid 58 and name O6 ) (resid 97 and name N4 ) 2.90 0.3 0.3 assign (resid 58 and name H1 ) (resid 97 and name N3 ) 2.00 0.2 0.2 assign (resid 58 and name N1 ) (resid 97 and name N3 ) 2.90 0.3 0.3 assign (resid 58 and name H21) (resid 97 and name O2 ) 2.00 0.2 0.2 assign (resid 58 and name N2 ) (resid 97 and name O2 ) 2.90 0.3 0.3 ! ! Gua 59 -- Cyt 96 assign (resid 59 and name O6 ) (resid 96 and name H41) 2.00 0.2 0.2 assign (resid 59 and name O6 ) (resid 96 and name N4 ) 2.90 0.3 0.3 assign (resid 59 and name H1 ) (resid 96 and name N3 ) 2.00 0.2 0.2 assign (resid 59 and name N1 ) (resid 96 and name N3 ) 2.90 0.3 0.3 assign (resid 59 and name H21) (resid 96 and name O2 ) 2.00 0.2 0.2 assign (resid 59 and name N2 ) (resid 96 and name O2 ) 2.90 0.3 0.3 ! ! Ade 95 -- Uri 60 assign (resid 95 and name H61) (resid 60 and name O4 ) 2.00 0.2 0.2 assign (resid 95 and name N6 ) (resid 60 and name O4 ) 2.90 0.3 0.3 assign (resid 95 and name N1 ) (resid 60 and name H3 ) 2.00 0.2 0.2 assign (resid 95 and name N1 ) (resid 60 and name N3 ) 2.90 0.3 0.3 ! ! Ade 62 -- Uri 93 assign (resid 62 and name H61) (resid 93 and name O4 ) 2.00 0.2 0.2 assign (resid 62 and name N6 ) (resid 93 and name O4 ) 2.90 0.3 0.3 assign (resid 62 and name N1 ) (resid 93 and name H3 ) 2.00 0.2 0.2 assign (resid 62 and name N1 ) (resid 93 and name N3 ) 2.90 0.3 0.3 ! ! Gua 92 -- Cyt 63 assign (resid 92 and name O6 ) (resid 63 and name H41) 2.00 0.2 0.2 assign (resid 92 and name O6 ) (resid 63 and name N4 ) 2.90 0.3 0.3 assign (resid 92 and name H1 ) (resid 63 and name N3 ) 2.00 0.2 0.2 assign (resid 92 and name N1 ) (resid 63 and name N3 ) 2.90 0.3 0.3 assign (resid 92 and name H21) (resid 63 and name O2 ) 2.00 0.2 0.2 assign (resid 92 and name N2 ) (resid 63 and name O2 ) 2.90 0.3 0.3 ! ! Gua 91 -- Cyt 64 assign (resid 91 and name O6 ) (resid 64 and name H41) 2.00 0.2 0.2 assign (resid 91 and name O6 ) (resid 64 and name N4 ) 2.90 0.3 0.3 assign (resid 91 and name H1 ) (resid 64 and name N3 ) 2.00 0.2 0.2 assign (resid 91 and name N1 ) (resid 64 and name N3 ) 2.90 0.3 0.3 assign (resid 91 and name H21) (resid 64 and name O2 ) 2.00 0.2 0.2 assign (resid 91 and name N2 ) (resid 64 and name O2 ) 2.90 0.3 0.3 ! ! Ade 65 -- Uri 90 assign (resid 65 and name H61) (resid 90 and name O4 ) 2.00 0.2 0.2 assign (resid 65 and name N6 ) (resid 90 and name O4 ) 2.90 0.3 0.3 assign (resid 65 and name N1 ) (resid 90 and name H3 ) 2.00 0.2 0.2 assign (resid 65 and name N1 ) (resid 90 and name N3 ) 2.90 0.3 0.3 ! ! Gua 89 -- Cyt 66 assign (resid 89 and name O6 ) (resid 66 and name H41) 2.00 0.2 0.2 assign (resid 89 and name O6 ) (resid 66 and name N4 ) 2.90 0.3 0.3 assign (resid 89 and name H1 ) (resid 66 and name N3 ) 2.00 0.2 0.2 assign (resid 89 and name N1 ) (resid 66 and name N3 ) 2.90 0.3 0.3 assign (resid 89 and name H21) (resid 66 and name O2 ) 2.00 0.2 0.2 assign (resid 89 and name N2 ) (resid 66 and name O2 ) 2.90 0.3 0.3 ! ! Gua 82 -- Cyt 73 assign (resid 82 and name O6 ) (resid 73 and name H41) 2.00 0.2 0.2 assign (resid 82 and name O6 ) (resid 73 and name N4 ) 2.90 0.3 0.3 assign (resid 82 and name H1 ) (resid 73 and name N3 ) 2.00 0.2 0.2 assign (resid 82 and name N1 ) (resid 73 and name N3 ) 2.90 0.3 0.3 assign (resid 82 and name H21) (resid 73 and name O2 ) 2.00 0.2 0.2 assign (resid 82 and name N2 ) (resid 73 and name O2 ) 2.90 0.3 0.3 ! ! Gua 81 -- Cyt 74 assign (resid 81 and name O6 ) (resid 74 and name H41) 2.00 0.2 0.2 assign (resid 81 and name O6 ) (resid 74 and name N4 ) 2.90 0.3 0.3 assign (resid 81 and name H1 ) (resid 74 and name N3 ) 2.00 0.2 0.2 assign (resid 81 and name N1 ) (resid 74 and name N3 ) 2.90 0.3 0.3 assign (resid 81 and name H21) (resid 74 and name O2 ) 2.00 0.2 0.2 assign (resid 81 and name N2 ) (resid 74 and name O2 ) 2.90 0.3 0.3 ! ! Gua 80 -- Cyt 75 assign (resid 80 and name O6 ) (resid 75 and name H41) 2.00 0.2 0.2 assign (resid 80 and name O6 ) (resid 75 and name N4 ) 2.90 0.3 0.3 assign (resid 80 and name H1 ) (resid 75 and name N3 ) 2.00 0.2 0.2 assign (resid 80 and name N1 ) (resid 75 and name N3 ) 2.90 0.3 0.3 assign (resid 80 and name H21) (resid 75 and name O2 ) 2.00 0.2 0.2 assign (resid 80 and name N2 ) (resid 75 and name O2 ) 2.90 0.3 0.3 !# Pesudo-knot 1: J1-2 ! ! Ade 41 -- Uri 99 assign (resid 41 and name H61) (resid 99 and name O4 ) 2.00 0.2 0.2 assign (resid 41 and name N6 ) (resid 99 and name O4 ) 2.90 0.3 0.3 assign (resid 41 and name N1 ) (resid 99 and name H3 ) 2.00 0.2 0.2 assign (resid 41 and name N1 ) (resid 99 and name N3 ) 2.90 0.3 0.3 ! ! Gua 40 -- Cyt 100 assign (resid 40 and name O6 ) (resid 100 and name H41) 2.00 0.2 0.2 assign (resid 40 and name O6 ) (resid 100 and name N4 ) 2.90 0.3 0.3 assign (resid 40 and name H1 ) (resid 100 and name N3 ) 2.00 0.2 0.2 assign (resid 40 and name N1 ) (resid 100 and name N3 ) 2.90 0.3 0.3 assign (resid 40 and name H21) (resid 100 and name O2 ) 2.00 0.2 0.2 assign (resid 40 and name N2 ) (resid 100 and name O2 ) 2.90 0.3 0.3 ! ! Gua 39 -- Cyt 101 assign (resid 39 and name O6 ) (resid 101 and name H41) 2.00 0.2 0.2 assign (resid 39 and name O6 ) (resid 101 and name N4 ) 2.90 0.3 0.3 assign (resid 39 and name H1 ) (resid 101 and name N3 ) 2.00 0.2 0.2 assign (resid 39 and name N1 ) (resid 101 and name N3 ) 2.90 0.3 0.3 assign (resid 39 and name H21) (resid 101 and name O2 ) 2.00 0.2 0.2 assign (resid 39 and name N2 ) (resid 101 and name O2 ) 2.90 0.3 0.3 ! ! Gua 102 -- Uri 38 * standard anti-anti G-U wobble pair assign (resid 102 and name O6 ) (resid 38 and name H3 ) 2.00 0.2 0.2 assign (resid 102 and name O6 ) (resid 38 and name N3 ) 2.90 0.3 0.3 assign (resid 102 and name H1 ) (resid 38 and name O2 ) 2.00 0.2 0.2 assign (resid 102 and name N1 ) (resid 38 and name O2 ) 2.90 0.3 0.3
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