NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type | subtype | subsubtype |
611256 | 5l06 | 30148 | cing | 1-original | 4 | AMBER | distance | hydrogen bond | simple |
#RESTRAINTS FOR H-BOND OR WC # # 10 DG H1 15 DMC N3 1.8 2 &rst ixpk= 0, nxpk= 0, iat= 306, 464, r1= 1.30, r2= 1.80, r3= 2.00, r4= 2.50, rk2=20.0, rk3=20.0, ir6=1, ialtd=0, &end # # 10 DG H21 15 DMC O2 1.7 2 &rst ixpk= 0, nxpk= 0, iat= 309, 463, r1= 1.20, r2= 1.70, r3= 2.00, r4= 2.50, &end # # 10 DG N1 15 DMC N3 2.8 3 &rst ixpk= 0, nxpk= 0, iat= 305, 464, r1= 2.30, r2= 2.80, r3= 3.00, r4= 3.50, &end # # 10 DG N2 15 DMC O2 2.7 3 &rst ixpk= 0, nxpk= 0, iat= 308, 463, r1= 2.20, r2= 2.70, r3= 3.00, r4= 3.50, &end # # 10 DG O6 15 DMC H41 1.8 2 &rst ixpk= 0, nxpk= 0, iat= 304, 467, r1= 1.30, r2= 1.80, r3= 2.00, r4= 2.50, &end # # 10 DG O6 15 DMC N4 2.8 3 &rst ixpk= 0, nxpk= 0, iat= 304, 466, r1= 2.30, r2= 2.80, r3= 3.00, r4= 3.50, &end # # 11 DC H41 14 DG O6 1.8 2 &rst ixpk= 0, nxpk= 0, iat= 338, 429, r1= 1.30, r2= 1.80, r3= 2.00, r4= 2.50, &end # # 11 DC N3 14 DG H1 1.8 2 &rst ixpk= 0, nxpk= 0, iat= 340, 431, r1= 1.30, r2= 1.80, r3= 2.00, r4= 2.50, &end # # 11 DC N3 14 DG N1 2.7 3 &rst ixpk= 0, nxpk= 0, iat= 340, 430, r1= 2.20, r2= 2.70, r3= 3.00, r4= 3.50, &end # # 11 DC N4 14 DG O6 2.7 3 &rst ixpk= 0, nxpk= 0, iat= 337, 429, r1= 2.20, r2= 2.70, r3= 3.00, r4= 3.50, &end # # 11 DC O2 14 DG H21 1.8 2 &rst ixpk= 0, nxpk= 0, iat= 342, 434, r1= 1.30, r2= 1.80, r3= 2.00, r4= 2.50, &end # # 11 DC O2 14 DG N2 2.7 3 &rst ixpk= 0, nxpk= 0, iat= 342, 433, r1= 2.20, r2= 2.70, r3= 3.00, r4= 3.50, &end # # 12 DG H1 13 DC N3 1.8 2 &rst ixpk= 0, nxpk= 0, iat= 369, 402, r1= 1.30, r2= 1.80, r3= 2.00, r4= 2.50, &end # # 12 DG H21 13 DC O2 1.8 2 &rst ixpk= 0, nxpk= 0, iat= 372, 404, r1= 1.30, r2= 1.80, r3= 2.00, r4= 2.50, &end # # 12 DG N1 13 DC N3 2.7 3 &rst ixpk= 0, nxpk= 0, iat= 368, 402, r1= 2.20, r2= 2.70, r3= 3.00, r4= 3.50, &end # # 12 DG N2 13 DC O2 2.7 3 &rst ixpk= 0, nxpk= 0, iat= 371, 404, r1= 2.20, r2= 2.70, r3= 3.00, r4= 3.50, &end # # 12 DG O6 13 DC H41 1.8 2 &rst ixpk= 0, nxpk= 0, iat= 367, 400, r1= 1.30, r2= 1.80, r3= 2.00, r4= 2.50, &end # # 12 DG O6 13 DC N4 2.7 3 &rst ixpk= 0, nxpk= 0, iat= 367, 399, r1= 2.20, r2= 2.70, r3= 3.00, r4= 3.50, &end # # 1 DC H41 24 DG O6 1.8 2 &rst ixpk= 0, nxpk= 0, iat= 18, 749, r1= 1.30, r2= 1.80, r3= 2.00, r4= 2.50, &end # # 1 DC N3 24 DG H1 1.8 2 &rst ixpk= 0, nxpk= 0, iat= 20, 751, r1= 1.30, r2= 1.80, r3= 2.00, r4= 2.50, &end # # 1 DC N3 24 DG N1 2.7 3 &rst ixpk= 0, nxpk= 0, iat= 20, 750, r1= 2.20, r2= 2.70, r3= 3.00, r4= 3.50, &end # # 1 DC N4 24 DG O6 2.7 3 &rst ixpk= 0, nxpk= 0, iat= 17, 749, r1= 2.20, r2= 2.70, r3= 3.00, r4= 3.50, &end # # 1 DC O2 24 DG H21 1.8 2 &rst ixpk= 0, nxpk= 0, iat= 22, 754, r1= 1.30, r2= 1.80, r3= 2.00, r4= 2.50, &end # # 1 DC O2 24 DG N2 2.7 3 &rst ixpk= 0, nxpk= 0, iat= 22, 753, r1= 2.20, r2= 2.70, r3= 3.00, r4= 3.50, &end # # 2 DG H1 23 DC N3 1.8 2 &rst ixpk= 0, nxpk= 0, iat= 49, 722, r1= 1.30, r2= 1.80, r3= 2.00, r4= 2.50, &end # # 2 DG H21 23 DC O2 1.8 2 &rst ixpk= 0, nxpk= 0, iat= 52, 724, r1= 1.30, r2= 1.80, r3= 2.00, r4= 2.50, &end # # 2 DG N1 23 DC N3 2.7 3 &rst ixpk= 0, nxpk= 0, iat= 48, 722, r1= 2.20, r2= 2.70, r3= 3.00, r4= 3.50, &end # # 2 DG N2 23 DC O2 2.7 3 &rst ixpk= 0, nxpk= 0, iat= 51, 724, r1= 2.20, r2= 2.70, r3= 3.00, r4= 3.50, &end # # 2 DG O6 23 DC H41 1.8 2 &rst ixpk= 0, nxpk= 0, iat= 47, 720, r1= 1.30, r2= 1.80, r3= 2.00, r4= 2.50, &end # # 2 DG O6 23 DC N4 2.7 3 &rst ixpk= 0, nxpk= 0, iat= 47, 719, r1= 2.20, r2= 2.70, r3= 3.00, r4= 3.50, &end # # 3 DMC H41 22 DG O6 1.8 2 &rst ixpk= 0, nxpk= 0, iat= 85, 686, r1= 1.30, r2= 1.80, r3= 2.00, r4= 2.50, &end # # 3 DMC N3 22 DG H1 1.8 2 &rst ixpk= 0, nxpk= 0, iat= 82, 688, r1= 1.30, r2= 1.80, r3= 2.00, r4= 2.50, &end # # 3 DMC N3 22 DG N1 2.7 3 &rst ixpk= 0, nxpk= 0, iat= 82, 687, r1= 2.20, r2= 2.70, r3= 3.00, r4= 3.50, &end # # 3 DMC N4 22 DG O6 2.7 3 &rst ixpk= 0, nxpk= 0, iat= 84, 686, r1= 2.20, r2= 2.70, r3= 3.00, r4= 3.50, &end # # 3 DMC O2 22 DG H21 1.8 2 &rst ixpk= 0, nxpk= 0, iat= 81, 691, r1= 1.30, r2= 1.80, r3= 2.00, r4= 2.50, &end # # 3 DMC O2 22 DG N2 2.7 3 &rst ixpk= 0, nxpk= 0, iat= 81, 690, r1= 2.20, r2= 2.70, r3= 3.00, r4= 3.50, &end # # 4 DG O6 21 DC H41 1.8 2 &rst ixpk= 0, nxpk= 0, iat= 113, 657, r1= 1.30, r2= 1.80, r3= 2.00, r4= 2.50, &end # # 4 DG O6 21 DC N4 2.7 3 &rst ixpk= 0, nxpk= 0, iat= 113, 656, r1= 2.20, r2= 2.70, r3= 3.00, r4= 3.50, &end # # 4 DG H1 21 DC N3 1.8 2 &rst ixpk= 0, nxpk= 0, iat= 115, 659, r1= 1.30, r2= 1.80, r3= 2.00, r4= 2.50, &end # # 4 DG H21 21 DC O2 1.8 2 &rst ixpk= 0, nxpk= 0, iat= 118, 661, r1= 1.30, r2= 1.80, r3= 2.00, r4= 2.50, &end # # 4 DG N1 21 DC N3 2.7 3 &rst ixpk= 0, nxpk= 0, iat= 114, 659, r1= 2.20, r2= 2.70, r3= 3.00, r4= 3.50, &end # # 4 DG N2 21 DC O2 2.7 3 &rst ixpk= 0, nxpk= 0, iat= 117, 661, r1= 2.20, r2= 2.70, r3= 3.00, r4= 3.50, &end # # 5 DA H61 20 DT O4 1.8 2 &rst ixpk= 0, nxpk= 0, iat= 147, 627, r1= 1.30, r2= 1.80, r3= 2.00, r4= 2.50, &end # # 5 DA N1 20 DT H3 1.8 2 &rst ixpk= 0, nxpk= 0, iat= 149, 629, r1= 1.30, r2= 1.80, r3= 2.00, r4= 2.50, &end # # 5 DA N1 20 DT N3 2.7 3 &rst ixpk= 0, nxpk= 0, iat= 149, 628, r1= 2.20, r2= 2.70, r3= 3.00, r4= 3.50, &end # # 5 DA N6 20 DT O4 2.7 3 &rst ixpk= 0, nxpk= 0, iat= 146, 627, r1= 2.20, r2= 2.70, r3= 3.00, r4= 3.50, &end # # 6 DA H61 19 DT O4 1.8 2 &rst ixpk= 0, nxpk= 0, iat= 179, 595, r1= 1.30, r2= 1.80, r3= 2.00, r4= 2.50, &end # # 6 DA N1 19 DT H3 1.8 2 &rst ixpk= 0, nxpk= 0, iat= 181, 597, r1= 1.30, r2= 1.80, r3= 2.00, r4= 2.50, &end # # 6 DA N1 19 DT N3 2.7 3 &rst ixpk= 0, nxpk= 0, iat= 181, 596, r1= 2.20, r2= 2.70, r3= 3.00, r4= 3.50, &end # # 6 DA N6 19 DT O4 2.7 3 &rst ixpk= 0, nxpk= 0, iat= 178, 595, r1= 2.20, r2= 2.70, r3= 3.00, r4= 3.50, &end # # 7 DT H3 18 DA N1 1.8 2 &rst ixpk= 0, nxpk= 0, iat= 215, 563, r1= 1.30, r2= 1.80, r3= 2.00, r4= 2.50, &end # # 7 DT N3 18 DA N1 2.7 3 &rst ixpk= 0, nxpk= 0, iat= 214, 563, r1= 2.20, r2= 2.70, r3= 3.00, r4= 3.50, &end # # 7 DT O4 18 DA H61 1.8 2 &rst ixpk= 0, nxpk= 0, iat= 213, 561, r1= 1.30, r2= 1.80, r3= 2.00, r4= 2.50, &end # # 7 DT O4 18 DA N6 2.7 3 &rst ixpk= 0, nxpk= 0, iat= 213, 560, r1= 2.20, r2= 2.70, r3= 3.00, r4= 3.50, &end # # 8 DT H3 17 DA N1 1.8 2 &rst ixpk= 0, nxpk= 0, iat= 247, 531, r1= 1.30, r2= 1.80, r3= 2.00, r4= 2.50, &end # # 8 DT N3 17 DA N1 2.7 3 &rst ixpk= 0, nxpk= 0, iat= 246, 531, r1= 2.20, r2= 2.70, r3= 3.00, r4= 3.50, &end # # 8 DT O4 17 DA H61 1.8 2 &rst ixpk= 0, nxpk= 0, iat= 245, 529, r1= 1.30, r2= 1.80, r3= 2.00, r4= 2.50, &end # # 8 DT O4 17 DA N6 2.7 3 &rst ixpk= 0, nxpk= 0, iat= 245, 528, r1= 2.20, r2= 2.70, r3= 3.00, r4= 3.50, &end # # 9 DC H41 16 DG O6 1.8 2 &rst ixpk= 0, nxpk= 0, iat= 275, 495, r1= 1.30, r2= 1.80, r3= 2.00, r4= 2.50, &end # # 9 DC N3 16 DG H1 1.8 2 &rst ixpk= 0, nxpk= 0, iat= 277, 497, r1= 1.30, r2= 1.80, r3= 2.00, r4= 2.50, &end # # 9 DC N3 16 DG N1 2.7 3 &rst ixpk= 0, nxpk= 0, iat= 277, 496, r1= 2.20, r2= 2.70, r3= 3.00, r4= 3.50, &end # # 9 DC N4 16 DG O6 2.7 3 &rst ixpk= 0, nxpk= 0, iat= 274, 495, r1= 2.20, r2= 2.70, r3= 3.00, r4= 3.50, &end # # 9 DC O2 16 DG H21 1.8 2 &rst ixpk= 0, nxpk= 0, iat= 279, 500, r1= 1.30, r2= 1.80, r3= 2.00, r4= 2.50, &end # # 9 DC O2 16 DG N2 2.7 3 &rst ixpk= 0, nxpk= 0, iat= 279, 499, r1= 2.20, r2= 2.70, r3= 3.00, r4= 3.50, &end
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