NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type | subtype | subsubtype |
616732 | 5m2l | 34054 | cing | 1-original | 2 | AMBER | distance | hydrogen bond | simple |
# # ## Restraints file 2: H_bonds.txt # # H_bonds # # # 15 DG H1 45 DG O6 1.7 2 &rst ixpk= 0, nxpk= 0, iat= 472,1440, r1= 1.20, r2= 1.70, r3= 2.40, r4= 2.80, rk2=20.0, rk3=20.0, ir6=1, ialtd=0, &end # # 15 DG O6 45 DG H1 1.7 2 &rst ixpk= 0, nxpk= 0, iat= 470,1442, r1= 1.20, r2= 1.70, r3= 2.40, r4= 2.80, &end # # 17 DC H41 13 DG O6 1.7 1.9 &rst ixpk= 0, nxpk= 0, iat= 536, 404, r1= 1.20, r2= 1.70, r3= 1.90, r4= 2.40, &end # # 17 DC N3 13 DG H1 1.8 2 &rst ixpk= 0, nxpk= 0, iat= 538, 406, r1= 1.30, r2= 1.80, r3= 2.00, r4= 2.50, &end # # 17 DC O2 13 DG H21 1.8 2 &rst ixpk= 0, nxpk= 0, iat= 540, 409, r1= 1.30, r2= 1.80, r3= 2.00, r4= 2.50, &end # # 47 DC H41 43 DG O6 1.7 1.9 &rst ixpk= 0, nxpk= 0, iat=1506,1374, r1= 1.20, r2= 1.70, r3= 1.90, r4= 2.40, &end # # 47 DC N3 43 DG H1 1.8 2 &rst ixpk= 0, nxpk= 0, iat=1508,1376, r1= 1.30, r2= 1.80, r3= 2.00, r4= 2.50, &end # # 47 DC O2 43 DG H21 1.8 2 &rst ixpk= 0, nxpk= 0, iat=1510,1379, r1= 1.30, r2= 1.80, r3= 2.00, r4= 2.50, &end # # 18 DG H1 12 DA N7 1.9 2.1 &rst ixpk= 0, nxpk= 0, iat= 567, 369, r1= 1.40, r2= 1.90, r3= 2.20, r4= 2.70, &end # # 18 DG O6 12 DA H61 1.7 1.9 &rst ixpk= 0, nxpk= 0, iat= 565, 373, r1= 1.20, r2= 1.70, r3= 2.30, r4= 2.80, &end # # 48 DG N7 12 DA H62 1.9 2.4 &rst ixpk= 0, nxpk= 0, iat=1532, 374, r1= 1.40, r2= 1.90, r3= 2.60, r4= 3.00, &end # # 48 DG H1 42 DA N7 1.9 2.1 &rst ixpk= 0, nxpk= 0, iat=1537,1339, r1= 1.40, r2= 1.90, r3= 2.20, r4= 2.70, &end # # 48 DG O6 42 DA H61 1.7 1.9 &rst ixpk= 0, nxpk= 0, iat=1535,1343, r1= 1.20, r2= 1.70, r3= 2.30, r4= 2.80, &end # # 18 DG N7 42 DA H62 1.9 2.4 &rst ixpk= 0, nxpk= 0, iat= 562,1344, r1= 1.40, r2= 1.90, r3= 2.60, r4= 3.00, &end # # 11 DG H1 19 DA N7 1.9 2.1 &rst ixpk= 0, nxpk= 0, iat= 341, 595, r1= 1.40, r2= 1.90, r3= 2.20, r4= 2.70, &end # # 11 DG O6 19 DA H61 1.7 1.9 &rst ixpk= 0, nxpk= 0, iat= 339, 599, r1= 1.20, r2= 1.70, r3= 2.30, r4= 2.80, &end # # 41 DG N7 19 DA H62 1.9 2.1 &rst ixpk= 0, nxpk= 0, iat=1306, 600, r1= 1.40, r2= 1.90, r3= 2.60, r4= 3.00, &end # # 41 DG H1 49 DA N7 1.9 2.1 &rst ixpk= 0, nxpk= 0, iat=1311,1565, r1= 1.40, r2= 1.90, r3= 2.20, r4= 2.70, &end # # 41 DG O6 49 DA H61 1.7 1.9 &rst ixpk= 0, nxpk= 0, iat=1309,1569, r1= 1.20, r2= 1.70, r3= 2.30, r4= 2.80, &end # # 11 DG N7 49 DA H62 1.9 2.1 &rst ixpk= 0, nxpk= 0, iat= 336,1570, r1= 1.40, r2= 1.90, r3= 2.60, r4= 3.00, &end # # 10 DC H41 50 DG O6 1.7 1.9 &rst ixpk= 0, nxpk= 0, iat= 310,1600, r1= 1.20, r2= 1.70, r3= 1.90, r4= 2.40, &end # # 10 DC N3 50 DG H1 1.8 2 &rst ixpk= 0, nxpk= 0, iat= 312,1602, r1= 1.30, r2= 1.80, r3= 2.00, r4= 2.50, &end # # 10 DC O2 50 DG H21 1.8 2 &rst ixpk= 0, nxpk= 0, iat= 314,1605, r1= 1.30, r2= 1.80, r3= 2.00, r4= 2.50, &end # # 40 DC H41 20 DG O6 1.7 1.9 &rst ixpk= 0, nxpk= 0, iat=1280, 630, r1= 1.20, r2= 1.70, r3= 1.90, r4= 2.40, &end # # 40 DC N3 20 DG H1 1.8 2 &rst ixpk= 0, nxpk= 0, iat=1282, 632, r1= 1.30, r2= 1.80, r3= 2.00, r4= 2.50, &end # # 40 DC O2 20 DG H21 1.8 2 &rst ixpk= 0, nxpk= 0, iat=1284, 635, r1= 1.30, r2= 1.80, r3= 2.00, r4= 2.50, &end # # 22 DG H1 8 DA N7 1.9 2.1 &rst ixpk= 0, nxpk= 0, iat= 698, 241, r1= 1.00, r2= 1.90, r3= 2.10, r4= 3.00, &end # # 22 DG O6 8 DA H61 1.7 1.9 &rst ixpk= 0, nxpk= 0, iat= 696, 245, r1= 1.00, r2= 1.90, r3= 2.10, r4= 3.00, &end # # 52 DG N7 8 DA H62 1.9 2.1 &rst ixpk= 0, nxpk= 0, iat=1663, 246, r1= 1.00, r2= 1.50, r3= 2.50, r4= 3.00, &end # # 52 DG H1 38 DA N7 1.9 2.1 &rst ixpk= 0, nxpk= 0, iat=1668,1211, r1= 1.00, r2= 1.90, r3= 2.10, r4= 3.00, &end # # 52 DG O6 38 DA H61 1.7 1.9 &rst ixpk= 0, nxpk= 0, iat=1666,1215, r1= 1.00, r2= 1.90, r3= 2.10, r4= 3.00, &end # # 22 DG N7 38 DA H62 1.9 2.1 &rst ixpk= 0, nxpk= 0, iat= 693,1216, r1= 1.00, r2= 1.50, r3= 2.50, r4= 3.00, &end # # 7 DG H1 23 DA N7 1.9 2.1 &rst ixpk= 0, nxpk= 0, iat= 213, 726, r1= 1.00, r2= 1.90, r3= 2.10, r4= 3.00, &end # # 7 DG O6 23 DA H61 1.7 1.9 &rst ixpk= 0, nxpk= 0, iat= 211, 730, r1= 1.00, r2= 1.90, r3= 2.10, r4= 3.00, &end # # 37 DG N7 23 DA H62 1.9 2.1 &rst ixpk= 0, nxpk= 0, iat=1178, 731, r1= 1.00, r2= 1.50, r3= 2.50, r4= 3.00, &end # # 37 DG H1 53 DA N7 1.9 2.1 &rst ixpk= 0, nxpk= 0, iat=1183,1696, r1= 1.00, r2= 1.50, r3= 2.50, r4= 3.00, &end # # 37 DG O6 53 DA H61 1.7 1.9 &rst ixpk= 0, nxpk= 0, iat=1181,1700, r1= 1.00, r2= 1.50, r3= 2.50, r4= 3.00, &end # # 7 DG N7 53 DA H62 1.9 2.1 &rst ixpk= 0, nxpk= 0, iat= 208,1701, r1= 1.00, r2= 1.50, r3= 2.50, r4= 3.00, &end # # 25 DC H41 35 DG O6 1.7 1.9 &rst ixpk= 0, nxpk= 0, iat= 795,1115, r1= 1.20, r2= 1.70, r3= 1.90, r4= 2.40, &end # # 25 DC N3 35 DG H1 1.8 2 &rst ixpk= 0, nxpk= 0, iat= 797,1117, r1= 1.30, r2= 1.80, r3= 2.00, r4= 2.50, &end # # 25 DC O2 35 DG H21 1.8 2 &rst ixpk= 0, nxpk= 0, iat= 799,1120, r1= 1.30, r2= 1.80, r3= 2.00, r4= 2.50, &end # # 55 DC H41 5 DG O6 1.7 1.9 &rst ixpk= 0, nxpk= 0, iat=1765, 145, r1= 1.20, r2= 1.70, r3= 1.90, r4= 2.40, &end # # 55 DC N3 5 DG H1 1.8 2 &rst ixpk= 0, nxpk= 0, iat=1767, 147, r1= 1.30, r2= 1.80, r3= 2.00, r4= 2.50, &end # # 55 DC O2 5 DG H21 1.8 2 &rst ixpk= 0, nxpk= 0, iat=1769, 150, r1= 1.30, r2= 1.80, r3= 2.00, r4= 2.50, &end # # 26 DG H1 4 DA N7 1.9 2.1 &rst ixpk= 0, nxpk= 0, iat= 826, 110, r1= 1.40, r2= 1.90, r3= 2.20, r4= 2.70, &end # # 26 DG O6 4 DA H61 1.7 1.9 &rst ixpk= 0, nxpk= 0, iat= 824, 114, r1= 1.20, r2= 1.70, r3= 2.30, r4= 2.80, &end # # 56 DG N7 4 DA H62 1.9 2.1 &rst ixpk= 0, nxpk= 0, iat=1791, 115, r1= 1.40, r2= 1.90, r3= 2.60, r4= 3.00, &end # # 56 DG H1 34 DA N7 1.9 2.1 &rst ixpk= 0, nxpk= 0, iat=1796,1080, r1= 1.40, r2= 1.90, r3= 2.20, r4= 2.70, &end # # 56 DG O6 34 DA H61 1.7 1.9 &rst ixpk= 0, nxpk= 0, iat=1794,1084, r1= 1.20, r2= 1.70, r3= 2.30, r4= 2.80, &end # # 26 DG N7 34 DA H62 1.9 2.1 &rst ixpk= 0, nxpk= 0, iat= 821,1085, r1= 1.40, r2= 1.90, r3= 2.60, r4= 3.00, &end # # 3 DG H1 27 DA N7 1.9 2.1 &rst ixpk= 0, nxpk= 0, iat= 82, 854, r1= 1.40, r2= 1.90, r3= 2.20, r4= 2.70, &end # # 3 DG O6 27 DA H61 1.7 1.9 &rst ixpk= 0, nxpk= 0, iat= 80, 858, r1= 1.20, r2= 1.70, r3= 2.30, r4= 2.80, &end # # 33 DG N7 27 DA H62 1.9 2.1 &rst ixpk= 0, nxpk= 0, iat=1047, 859, r1= 1.40, r2= 1.90, r3= 2.60, r4= 3.00, &end # # 33 DG H1 57 DA N7 1.9 2.1 &rst ixpk= 0, nxpk= 0, iat=1052,1824, r1= 1.40, r2= 1.90, r3= 2.20, r4= 2.70, &end # # 33 DG O6 57 DA H61 1.7 1.9 &rst ixpk= 0, nxpk= 0, iat=1050,1828, r1= 1.20, r2= 1.70, r3= 2.30, r4= 2.80, &end # # 3 DG N7 57 DA H62 1.9 2.1 &rst ixpk= 0, nxpk= 0, iat= 77,1829, r1= 1.40, r2= 1.90, r3= 2.60, r4= 3.00, &end # # 2 DC H41 28 DG O6 1.7 1.9 &rst ixpk= 0, nxpk= 0, iat= 51, 889, r1= 1.20, r2= 1.70, r3= 1.90, r4= 2.40, &end # # 2 DC N3 28 DG H1 1.8 2 &rst ixpk= 0, nxpk= 0, iat= 53, 891, r1= 1.30, r2= 1.80, r3= 2.00, r4= 2.50, &end # # 2 DC O2 28 DG H21 1.8 2 &rst ixpk= 0, nxpk= 0, iat= 55, 894, r1= 1.30, r2= 1.80, r3= 2.00, r4= 2.50, &end # # 32 DC H41 58 DG O6 1.7 1.9 &rst ixpk= 0, nxpk= 0, iat=1021,1859, r1= 1.20, r2= 1.70, r3= 1.90, r4= 2.40, &end # # 32 DC N3 58 DG H1 1.8 2 &rst ixpk= 0, nxpk= 0, iat=1023,1861, r1= 1.30, r2= 1.80, r3= 2.00, r4= 2.50, &end # # 32 DC O2 58 DG H21 1.8 2 &rst ixpk= 0, nxpk= 0, iat=1025,1864, r1= 1.30, r2= 1.80, r3= 2.00, r4= 2.50, &end # # 30 DG H1 60 DG O6 1.7 2 &rst ixpk= 0, nxpk= 0, iat= 957,1925, r1= 1.20, r2= 1.70, r3= 2.40, r4= 2.80, &end # # 30 DG O6 60 DG H1 1.7 2 &rst ixpk= 0, nxpk= 0, iat= 955,1927, r1= 1.20, r2= 1.70, r3= 2.40, r4= 2.80, &end # # # 21 DG N7 9 DG H21 1.5 2.5 &rst ixpk= 0, nxpk= 0, iat= 660, 281, r1= 1.00, r2= 1.50, r3= 2.60, r4= 3.00, rk2=20.0, rk3=20.0, ir6=1, ialtd=0, &end # # 21 DG O6 9 DG H1 1.5 2.5 &rst ixpk= 0, nxpk= 0, iat= 663, 278, r1= 1.00, r2= 1.50, r3= 2.60, r4= 3.00, &end # # 21 DG H1 39 DG O6 1.5 2.5 &rst ixpk= 0, nxpk= 0, iat= 665,1246, r1= 1.00, r2= 1.50, r3= 2.60, r4= 3.00, &end # # 21 DG H21 39 DG N7 1.5 2.5 &rst ixpk= 0, nxpk= 0, iat= 668,1243, r1= 1.00, r2= 1.50, r3= 2.60, r4= 3.00, &end # # 51 DG O6 39 DG H1 1.5 2.5 &rst ixpk= 0, nxpk= 0, iat=1633,1248, r1= 1.00, r2= 1.50, r3= 2.60, r4= 3.00, &end # # 51 DG N7 39 DG H21 1.5 2.5 &rst ixpk= 0, nxpk= 0, iat=1630,1251, r1= 1.00, r2= 1.50, r3= 2.60, r4= 3.00, &end # # 9 DG N7 51 DG H21 1.5 2.5 &rst ixpk= 0, nxpk= 0, iat= 273,1638, r1= 1.00, r2= 1.50, r3= 2.60, r4= 3.00, &end # # 9 DG O6 51 DG H1 1.5 2.5 &rst ixpk= 0, nxpk= 0, iat= 276,1635, r1= 1.00, r2= 1.50, r3= 2.60, r4= 3.00, &end # # 6 DG N7 24 DG H21 1.5 2.5 &rst ixpk= 0, nxpk= 0, iat= 175, 766, r1= 1.00, r2= 1.50, r3= 2.60, r4= 3.00, rk2=20.0, rk3=20.0, ir6=1, ialtd=0, &end # # 6 DG O6 24 DG H1 1.5 2.5 &rst ixpk= 0, nxpk= 0, iat= 178, 763, r1= 1.00, r2= 1.50, r3= 2.60, r4= 3.00, &end # # 6 DG H1 54 DG O6 1.5 2.5 &rst ixpk= 0, nxpk= 0, iat= 180,1731, r1= 1.00, r2= 1.50, r3= 2.60, r4= 3.00, &end # # 6 DG H21 54 DG N7 1.5 2.5 &rst ixpk= 0, nxpk= 0, iat= 183,1728, r1= 1.00, r2= 1.50, r3= 2.60, r4= 3.00, &end # # 36 DG O6 54 DG H1 1.5 2.5 &rst ixpk= 0, nxpk= 0, iat=1148,1733, r1= 1.00, r2= 1.50, r3= 2.60, r4= 3.00, &end # # 36 DG N7 54 DG H21 1.5 2.5 &rst ixpk= 0, nxpk= 0, iat=1145,1736, r1= 1.00, r2= 1.50, r3= 2.60, r4= 3.00, &end # # 24 DG N7 36 DG H21 1.5 2.5 &rst ixpk= 0, nxpk= 0, iat= 758,1153, r1= 1.00, r2= 1.50, r3= 2.60, r4= 3.00, &end # # 24 DG O6 36 DG H1 1.5 2.5 &rst ixpk= 0, nxpk= 0, iat= 761,1150, r1= 1.00, r2= 1.50, r3= 2.60, r4= 3.00, &end # # # 1 DG H1 31 DG O6 1.0 2.5 &rst ixpk= 0, nxpk= 0, iat= 19, 987, r1= 0.50, r2= 1.00, r3= 2.50, r4= 3.00, rk2=20.0, rk3=20.0, ir6=1, ialtd=0, &end # # 1 DG O6 31 DG H1 1.0 2.5 &rst ixpk= 0, nxpk= 0, iat= 17, 989, r1= 0.50, r2= 1.00, r3= 2.50, r4= 3.00, &end # # 29 DG H1 59 DG O6 1.0 2.5 &rst ixpk= 0, nxpk= 0, iat= 924,1892, r1= 0.50, r2= 1.00, r3= 2.50, r4= 3.00, rk2=20.0, rk3=20.0, ir6=1, ialtd=0, &end # # 29 DG O6 59 DG H1 1.0 2.5 &rst ixpk= 0, nxpk= 0, iat= 922,1894, r1= 0.50, r2= 1.00, r3= 2.50, r4= 3.00, &end # # # 14 DG H1 44 DG O6 1.0 2.5 &rst ixpk= 0, nxpk= 0, iat= 439,1407, r1= 0.50, r2= 1.00, r3= 2.50, r4= 3.00, rk2=20.0, rk3=20.0, ir6=1, ialtd=0, &end # # 14 DG O6 44 DG H1 1.0 2.5 &rst ixpk= 0, nxpk= 0, iat= 437,1409, r1= 0.50, r2= 1.00, r3= 2.50, r4= 3.00, &end # # # 16 DG H1 46 DG O6 1.0 2.5 &rst ixpk= 0, nxpk= 0, iat= 504,1472, r1= 0.50, r2= 1.00, r3= 2.50, r4= 3.00, rk2=20.0, rk3=20.0, ir6=1, ialtd=0, &end # # 16 DG O6 46 DG H1 1.0 2.5 &rst ixpk= 0, nxpk= 0, iat= 502,1474, r1= 0.50, r2= 1.00, r3= 2.50, r4= 3.00, &end
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