NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
492511 | 2kh4 | 16223 | cing | 1-original | 1 | AMBER | dihedral angle |
# 2 THY ALPHA: (1 DC5 O3')-(2 DT P)-(2 DT O5')-(2 DT C5') -120.0 -10.0 &rst iat = 28, 29, 32, 33, r1 = -121.0, r2 = -120.0, r3 = -10.0, r4 = -9.0, rk2 = 5.0, rk3 = 5.0, &end # 4 ADE ALPHA: (3 FAG O3')-(4 DA3 P)-(4 DA3 O5')-(4 DA3 C5') -120.0 -10.0 &rst iat = 90, 96, 99, 100, r1 = -121.0, r2 = -120.0, r3 = -10.0, r4 = -9.0, &end # 4 ADE BETA: (4 DA3 P)-(4 DA3 O5')-(4 DA3 C5')-(4 DA3 C4') 50.0 280.0 &rst iat = 96, 99, 100, 103, r1 = 49.0, r2 = 50.0, r3 = 280.0, r4 = 281.0, &end # 1 CYT GAMMA: (1 DC5 O5')-(1 DC5 C5')-(1 DC5 C4')-(1 DC5 C3') -20.0 140.0 &rst iat = 2, 3, 6, 23, r1 = -21.0, r2 = -20.0, r3 = 140.0, r4 = 141.0, &end # 3 GUA GAMMA: (3 FAG O5')-(3 FAG C5')-(3 FAG C4')-(3 FAG C3') -20.0 140.0 &rst iat = 64, 65, 68, 85, r1 = -21.0, r2 = -20.0, r3 = 140.0, r4 = 141.0, &end # 4 ADE GAMMA: (4 DA3 O5')-(4 DA3 C5')-(4 DA3 C4')-(4 DA3 C3') -20.0 140.0 &rst iat = 99, 100, 103, 122, r1 = -21.0, r2 = -20.0, r3 = 140.0, r4 = 141.0, &end # 1 CYT EPSILN: (1 DC5 C4')-(1 DC5 C3')-(1 DC5 O3')-(2 DT P) -210.0 30.0 &rst iat = 6, 23, 28, 29, r1 = -211.0, r2 = -210.0, r3 = 30.0, r4 = 31.0, &end # 1 CYT ZETA: (1 DC5 C3')-(1 DC5 O3')-(2 DT P)-(2 DT O5') 150.0 330.0 &rst iat = 23, 28, 29, 32, r1 = 149.0, r2 = 150.0, r3 = 330.0, r4 = 331.0, &end # 1 CYT CHI: (1 DC5 O4')-(1 DC5 C1')-(1 DC5 N1)-(1 DC5 C2) 180.0 340.0 &rst iat = 8, 9, 11, 21, r1 = 179.0, r2 = 180.0, r3 = 340.0, r4 = 341.0, &end # 2 THY CHI: (2 DT O4')-(2 DT C1')-(2 DT N1)-(2 DT C2) 180.0 340.0 &rst iat = 38, 39, 41, 53, r1 = 179.0, r2 = 180.0, r3 = 340.0, r4 = 341.0, &end # 4 ADE CHI: (4 DA3 O4')-(4 DA3 C1')-(4 DA3 N9)-(4 DA3 C4) 180.0 340.0 &rst iat = 105, 106, 108, 121, r1 = 179.0, r2 = 180.0, r3 = 340.0, r4 = 341.0, &end # 1 CYT NU0: (1 DC5 C4')-(1 DC5 O4')-(1 DC5 C1')-(1 DC5 C2') -38.5 17.5 &rst iat = 6, 8, 9, 25, r1 = -39.5, r2 = -38.5, r3 = 17.5, r4 = 18.5, &end # 1 CYT NU1: (1 DC5 O4')-(1 DC5 C1')-(1 DC5 C2')-(1 DC5 C3') -26.7 38.5 &rst iat = 8, 9, 25, 23, r1 = -27.7, r2 = -26.7, r3 = 38.5, r4 = 39.5, &end # 1 CYT NU2: (1 DC5 C1')-(1 DC5 C2')-(1 DC5 C3')-(1 DC5 C4') -38.5 37.9 &rst iat = 9, 25, 23, 6, r1 = -39.5, r2 = -38.5, r3 = 37.9, r4 = 38.9, &end # 1 CYT NU3: (1 DC5 C2')-(1 DC5 C3')-(1 DC5 C4')-(1 DC5 O4') -38.5 38.5 &rst iat = 25, 23, 6, 8, r1 = -39.5, r2 = -38.5, r3 = 38.5, r4 = 39.5, &end # 1 CYT NU4: (1 DC5 C3')-(1 DC5 C4')-(1 DC5 O4')-(1 DC5 C1') -34.3 38.5 &rst iat = 23, 6, 8, 9, r1 = -35.3, r2 = -34.3, r3 = 38.5, r4 = 39.5, &end # 3 GUA NU0: (3 FAG C4')-(3 FAG O4')-(3 FAG C1')-(3 FAG C2') -23.7 8.0 &rst iat = 68, 70, 71, 87, r1 = -24.7, r2 = -23.7, r3 = 8.0, r4 = 9.0, &end # 3 GUA NU1: (3 FAG O4')-(3 FAG C1')-(3 FAG C2')-(3 FAG C3') 11.4 41.4 &rst iat = 70, 71, 87, 85, r1 = 10.4, r2 = 11.4, r3 = 41.4, r4 = 42.4, &end # 3 GUA NU2: (3 FAG C1')-(3 FAG C2')-(3 FAG C3')-(3 FAG C4') -50.9 -20.9 &rst iat = 71, 87, 85, 68, r1 = -51.9, r2 = -50.9, r3 = -20.9, r4 = -19.9, &end # 3 GUA NU3: (3 FAG C2')-(3 FAG C3')-(3 FAG C4')-(3 FAG O4') 14.9 44.9 &rst iat = 87, 85, 68, 70, r1 = 13.9, r2 = 14.9, r3 = 44.9, r4 = 45.9, &end # 3 GUA NU4: (3 FAG C3')-(3 FAG C4')-(3 FAG O4')-(3 FAG C1') -28.6 1.4 &rst iat = 85, 68, 70, 71, r1 = -29.6, r2 = -28.6, r3 = 1.4, r4 = 2.4, &end # 4 ADE NU0: (4 DA3 C4')-(4 DA3 O4')-(4 DA3 C1')-(4 DA3 C2') -23.7 8.0 &rst iat = 103, 105, 106, 124, r1 = -24.7, r2 = -23.7, r3 = 8.0, r4 = 9.0, &end # 4 ADE NU1: (4 DA3 O4')-(4 DA3 C1')-(4 DA3 C2')-(4 DA3 C3') 11.4 41.4 &rst iat = 105, 106, 124, 122, r1 = 10.4, r2 = 11.4, r3 = 41.4, r4 = 42.4, &end # 4 ADE NU2: (4 DA3 C1')-(4 DA3 C2')-(4 DA3 C3')-(4 DA3 C4') -50.9 -20.9 &rst iat = 106, 124, 122, 103, r1 = -51.9, r2 = -50.9, r3 = -20.9, r4 = -19.9, &end # 4 ADE NU3: (4 DA3 C2')-(4 DA3 C3')-(4 DA3 C4')-(4 DA3 O4') 14.9 44.9 &rst iat = 124, 122, 103, 105, r1 = 13.9, r2 = 14.9, r3 = 44.9, r4 = 45.9, &end # 4 ADE NU4: (4 DA3 C3')-(4 DA3 C4')-(4 DA3 O4')-(4 DA3 C1') -28.6 1.4 &rst iat = 122, 103, 105, 106, r1 = -29.6, r2 = -28.6, r3 = 1.4, r4 = 2.4, &end #
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