NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | cing | stage | position | program | type |
|
|
583502 |
2mko   |
cing | 1-original | 5 | AMBER | dihedral angle |
#RST.sugar # # 359 atoms read from pdb file template.pdb. # 1 GUA NU0: (1 DG5 C4')-(1 DG5 O4')-(1 DG5 C1')-(1 DG5 C2') -32.3 -2.3 &rst iat = 6, 8, 9, 28, r1 = -33.3, r2 = -32.3, r3 = -2.3, r4 = -1.3, rk2 = 200.0, rk3 = 200.0, &end # 1 GUA NU1: (1 DG5 O4')-(1 DG5 C1')-(1 DG5 C2')-(1 DG5 C3') 18.9 48.9 &rst iat = 8, 9, 28, 26, r1 = 17.9, r2 = 18.9, r3 = 48.9, r4 = 49.9, &end # 1 GUA NU2: (1 DG5 C1')-(1 DG5 C2')-(1 DG5 C3')-(1 DG5 C4') -52.6 -22.6 &rst iat = 9, 28, 26, 6, r1 = -53.6, r2 = -52.6, r3 = -22.6, r4 = -21.6, &end # 1 GUA NU3: (1 DG5 C2')-(1 DG5 C3')-(1 DG5 C4')-(1 DG5 O4') 11.9 41.9 &rst iat = 28, 26, 6, 8, r1 = 10.9, r2 = 11.9, r3 = 41.9, r4 = 42.9, &end # 1 GUA NU4: (1 DG5 C3')-(1 DG5 C4')-(1 DG5 O4')-(1 DG5 C1') -20.9 9.1 &rst iat = 26, 6, 8, 9, r1 = -21.9, r2 = -20.9, r3 = 9.1, r4 = 10.1, &end # 2 GUA NU0: (2 DG C4')-(2 DG O4')-(2 DG C1')-(2 DG C2') -32.3 -2.3 &rst iat = 39, 41, 42, 61, r1 = -33.3, r2 = -32.3, r3 = -2.3, r4 = -1.3, &end # 2 GUA NU1: (2 DG O4')-(2 DG C1')-(2 DG C2')-(2 DG C3') 18.9 48.9 &rst iat = 41, 42, 61, 59, r1 = 17.9, r2 = 18.9, r3 = 48.9, r4 = 49.9, &end # 2 GUA NU2: (2 DG C1')-(2 DG C2')-(2 DG C3')-(2 DG C4') -52.6 -22.6 &rst iat = 42, 61, 59, 39, r1 = -53.6, r2 = -52.6, r3 = -22.6, r4 = -21.6, &end # 2 GUA NU3: (2 DG C2')-(2 DG C3')-(2 DG C4')-(2 DG O4') 11.9 41.9 &rst iat = 61, 59, 39, 41, r1 = 10.9, r2 = 11.9, r3 = 41.9, r4 = 42.9, &end # 2 GUA NU4: (2 DG C3')-(2 DG C4')-(2 DG O4')-(2 DG C1') -20.9 9.1 &rst iat = 59, 39, 41, 42, r1 = -21.9, r2 = -20.9, r3 = 9.1, r4 = 10.1, &end # 5 GUA NU0: (5 DG C4')-(5 DG O4')-(5 DG C1')-(5 DG C2') -32.3 -2.3 &rst iat = 136, 138, 139, 158, r1 = -33.3, r2 = -32.3, r3 = -2.3, r4 = -1.3, &end # 5 GUA NU1: (5 DG O4')-(5 DG C1')-(5 DG C2')-(5 DG C3') 18.9 48.9 &rst iat = 138, 139, 158, 156, r1 = 17.9, r2 = 18.9, r3 = 48.9, r4 = 49.9, &end # 5 GUA NU2: (5 DG C1')-(5 DG C2')-(5 DG C3')-(5 DG C4') -52.6 -22.6 &rst iat = 139, 158, 156, 136, r1 = -53.6, r2 = -52.6, r3 = -22.6, r4 = -21.6, &end # 5 GUA NU3: (5 DG C2')-(5 DG C3')-(5 DG C4')-(5 DG O4') 11.9 41.9 &rst iat = 158, 156, 136, 138, r1 = 10.9, r2 = 11.9, r3 = 41.9, r4 = 42.9, &end # 5 GUA NU4: (5 DG C3')-(5 DG C4')-(5 DG O4')-(5 DG C1') -20.9 9.1 &rst iat = 156, 136, 138, 139, r1 = -21.9, r2 = -20.9, r3 = 9.1, r4 = 10.1, &end # 6 GUA NU0: (6 DG C4')-(6 DG O4')-(6 DG C1')-(6 DG C2') -32.3 -2.3 &rst iat = 169, 171, 172, 191, r1 = -33.3, r2 = -32.3, r3 = -2.3, r4 = -1.3, &end # 6 GUA NU1: (6 DG O4')-(6 DG C1')-(6 DG C2')-(6 DG C3') 18.9 48.9 &rst iat = 171, 172, 191, 189, r1 = 17.9, r2 = 18.9, r3 = 48.9, r4 = 49.9, &end # 6 GUA NU2: (6 DG C1')-(6 DG C2')-(6 DG C3')-(6 DG C4') -52.6 -22.6 &rst iat = 172, 191, 189, 169, r1 = -53.6, r2 = -52.6, r3 = -22.6, r4 = -21.6, &end # 6 GUA NU3: (6 DG C2')-(6 DG C3')-(6 DG C4')-(6 DG O4') 11.9 41.9 &rst iat = 191, 189, 169, 171, r1 = 10.9, r2 = 11.9, r3 = 41.9, r4 = 42.9, &end # 6 GUA NU4: (6 DG C3')-(6 DG C4')-(6 DG O4')-(6 DG C1') -20.9 9.1 &rst iat = 189, 169, 171, 172, r1 = -21.9, r2 = -20.9, r3 = 9.1, r4 = 10.1, &end # 10 GUA NU0: (10 DG C4')-(10 DG O4')-(10 DG C1')-(10 DG C2') -32.3 -2.3 &rst iat = 299, 301, 302, 321, r1 = -33.3, r2 = -32.3, r3 = -2.3, r4 = -1.3, &end # 10 GUA NU1: (10 DG O4')-(10 DG C1')-(10 DG C2')-(10 DG C3') 18.9 48.9 &rst iat = 301, 302, 321, 319, r1 = 17.9, r2 = 18.9, r3 = 48.9, r4 = 49.9, &end # 10 GUA NU2: (10 DG C1')-(10 DG C2')-(10 DG C3')-(10 DG C4') -52.6 -22.6 &rst iat = 302, 321, 319, 299, r1 = -53.6, r2 = -52.6, r3 = -22.6, r4 = -21.6, &end # 10 GUA NU3: (10 DG C2')-(10 DG C3')-(10 DG C4')-(10 DG O4') 11.9 41.9 &rst iat = 321, 319, 299, 301, r1 = 10.9, r2 = 11.9, r3 = 41.9, r4 = 42.9, &end # 10 GUA NU4: (10 DG C3')-(10 DG C4')-(10 DG O4')-(10 DG C1') -20.9 9.1 &rst iat = 319, 299, 301, 302, r1 = -21.9, r2 = -20.9, r3 = 9.1, r4 = 10.1, &end # 8 GUA NU0: (8 DG C4')-(8 DG O4')-(8 DG C1')-(8 DG C2') -32.3 -2.3 &rst iat = 234, 236, 237, 256, r1 = -33.3, r2 = -32.3, r3 = -2.3, r4 = -1.3, &end # 8 GUA NU1: (8 DG O4')-(8 DG C1')-(8 DG C2')-(8 DG C3') 18.9 48.9 &rst iat = 236, 237, 256, 254, r1 = 17.9, r2 = 18.9, r3 = 48.9, r4 = 49.9, &end # 8 GUA NU2: (8 DG C1')-(8 DG C2')-(8 DG C3')-(8 DG C4') -52.6 -22.6 &rst iat = 237, 256, 254, 234, r1 = -53.6, r2 = -52.6, r3 = -22.6, r4 = -21.6, &end # 8 GUA NU3: (8 DG C2')-(8 DG C3')-(8 DG C4')-(8 DG O4') 11.9 41.9 &rst iat = 256, 254, 234, 236, r1 = 10.9, r2 = 11.9, r3 = 41.9, r4 = 42.9, &end # 8 GUA NU4: (8 DG C3')-(8 DG C4')-(8 DG O4')-(8 DG C1') -20.9 9.1 &rst iat = 254, 234, 236, 237, r1 = -21.9, r2 = -20.9, r3 = 9.1, r4 = 10.1, &end # 3 THY NU0: (3 DT C4')-(3 DT O4')-(3 DT C1')-(3 DT C2') -32.3 -2.3 &rst iat = 72, 74, 75, 93, r1 = -33.3, r2 = -32.3, r3 = -2.3, r4 = -1.3, &end # 3 THY NU1: (3 DT O4')-(3 DT C1')-(3 DT C2')-(3 DT C3') 18.9 48.9 &rst iat = 74, 75, 93, 91, r1 = 17.9, r2 = 18.9, r3 = 48.9, r4 = 49.9, &end # 3 THY NU2: (3 DT C1')-(3 DT C2')-(3 DT C3')-(3 DT C4') -52.6 -22.6 &rst iat = 75, 93, 91, 72, r1 = -53.6, r2 = -52.6, r3 = -22.6, r4 = -21.6, &end # 3 THY NU3: (3 DT C2')-(3 DT C3')-(3 DT C4')-(3 DT O4') 11.9 41.9 &rst iat = 93, 91, 72, 74, r1 = 10.9, r2 = 11.9, r3 = 41.9, r4 = 42.9, &end # 3 THY NU4: (3 DT C3')-(3 DT C4')-(3 DT O4')-(3 DT C1') -20.9 9.1 &rst iat = 91, 72, 74, 75, r1 = -21.9, r2 = -20.9, r3 = 9.1, r4 = 10.1, &end # 4 THY NU0: (4 DT C4')-(4 DT O4')-(4 DT C1')-(4 DT C2') -32.3 -2.3 &rst iat = 104, 106, 107, 125, r1 = -33.3, r2 = -32.3, r3 = -2.3, r4 = -1.3, &end # 4 THY NU1: (4 DT O4')-(4 DT C1')-(4 DT C2')-(4 DT C3') 18.9 48.9 &rst iat = 106, 107, 125, 123, r1 = 17.9, r2 = 18.9, r3 = 48.9, r4 = 49.9, &end # 4 THY NU2: (4 DT C1')-(4 DT C2')-(4 DT C3')-(4 DT C4') -52.6 -22.6 &rst iat = 107, 125, 123, 104, r1 = -53.6, r2 = -52.6, r3 = -22.6, r4 = -21.6, &end # 4 THY NU3: (4 DT C2')-(4 DT C3')-(4 DT C4')-(4 DT O4') 11.9 41.9 &rst iat = 125, 123, 104, 106, r1 = 10.9, r2 = 11.9, r3 = 41.9, r4 = 42.9, &end # 4 THY NU4: (4 DT C3')-(4 DT C4')-(4 DT O4')-(4 DT C1') -20.9 9.1 &rst iat = 123, 104, 106, 107, r1 = -21.9, r2 = -20.9, r3 = 9.1, r4 = 10.1, &end # 7 THY NU0: (7 DT C4')-(7 DT O4')-(7 DT C1')-(7 DT C2') -32.3 -2.3 &rst iat = 202, 204, 205, 223, r1 = -33.3, r2 = -32.3, r3 = -2.3, r4 = -1.3, &end # 7 THY NU1: (7 DT O4')-(7 DT C1')-(7 DT C2')-(7 DT C3') 18.9 48.9 &rst iat = 204, 205, 223, 221, r1 = 17.9, r2 = 18.9, r3 = 48.9, r4 = 49.9, &end # 7 THY NU2: (7 DT C1')-(7 DT C2')-(7 DT C3')-(7 DT C4') -52.6 -22.6 &rst iat = 205, 223, 221, 202, r1 = -53.6, r2 = -52.6, r3 = -22.6, r4 = -21.6, &end # 7 THY NU3: (7 DT C2')-(7 DT C3')-(7 DT C4')-(7 DT O4') 11.9 41.9 &rst iat = 223, 221, 202, 204, r1 = 10.9, r2 = 11.9, r3 = 41.9, r4 = 42.9, &end # 7 THY NU4: (7 DT C3')-(7 DT C4')-(7 DT O4')-(7 DT C1') -20.9 9.1 &rst iat = 221, 202, 204, 205, r1 = -21.9, r2 = -20.9, r3 = 9.1, r4 = 10.1, &end # 9 THY NU0: (9 DT C4')-(9 DT O4')-(9 DT C1')-(9 DT C2') -32.3 -2.3 &rst iat = 267, 269, 270, 288, r1 = -33.3, r2 = -32.3, r3 = -2.3, r4 = -1.3, &end # 9 THY NU1: (9 DT O4')-(9 DT C1')-(9 DT C2')-(9 DT C3') 18.9 48.9 &rst iat = 269, 270, 288, 286, r1 = 17.9, r2 = 18.9, r3 = 48.9, r4 = 49.9, &end # 9 THY NU2: (9 DT C1')-(9 DT C2')-(9 DT C3')-(9 DT C4') -52.6 -22.6 &rst iat = 270, 288, 286, 267, r1 = -53.6, r2 = -52.6, r3 = -22.6, r4 = -21.6, &end # 9 THY NU3: (9 DT C2')-(9 DT C3')-(9 DT C4')-(9 DT O4') 11.9 41.9 &rst iat = 288, 286, 267, 269, r1 = 10.9, r2 = 11.9, r3 = 41.9, r4 = 42.9, &end # 9 THY NU4: (9 DT C3')-(9 DT C4')-(9 DT O4')-(9 DT C1') -20.9 9.1 &rst iat = 286, 267, 269, 270, r1 = -21.9, r2 = -20.9, r3 = 9.1, r4 = 10.1, &end #rst.BB # 359 atoms read from pdb file template.pdb. # 2 GUA BETA: (2 DG P)-(2 DG O5')-(2 DG C5')-(2 DG C4') 130.0 230.0 &rst iat = 32, 35, 36, 39, r1 = 129.0, r2 = 130.0, r3 = 230.0, r4 = 231.0, rk2 = 200.0, rk3 = 200.0, &end # 5 GUA BETA: (5 DG P)-(5 DG O5')-(5 DG C5')-(5 DG C4') 130.0 230.0 &rst iat = 129, 132, 133, 136, r1 = 129.0, r2 = 130.0, r3 = 230.0, r4 = 231.0, &end # 6 GUA BETA: (6 DG P)-(6 DG O5')-(6 DG C5')-(6 DG C4') 130.0 230.0 &rst iat = 162, 165, 166, 169, r1 = 129.0, r2 = 130.0, r3 = 230.0, r4 = 231.0, &end # 10 GUA BETA: (10 DG P)-(10 DG O5')-(10 DG C5')-(10 DG C4') 130.0 230.0 &rst iat = 292, 295, 296, 299, r1 = 129.0, r2 = 130.0, r3 = 230.0, r4 = 231.0, &end # 11 GUA BETA: (11 DG3 P)-(11 DG3 O5')-(11 DG3 C5')-(11 DG3 C4') 130.0 230.0 &rst iat = 325, 328, 329, 332, r1 = 129.0, r2 = 130.0, r3 = 230.0, r4 = 231.0, &end # 8 GUA BETA: (8 DG P)-(8 DG O5')-(8 DG C5')-(8 DG C4') 130.0 230.0 &rst iat = 227, 230, 231, 234, r1 = 129.0, r2 = 130.0, r3 = 230.0, r4 = 231.0, &end # 1 GUA GAMMA: (1 DG5 O5')-(1 DG5 C5')-(1 DG5 C4')-(1 DG5 C3') 20.0 100.0 &rst iat = 2, 3, 6, 26, r1 = 19.0, r2 = 20.0, r3 = 100.0, r4 = 101.0, &end # 2 GUA GAMMA: (2 DG O5')-(2 DG C5')-(2 DG C4')-(2 DG C3') 20.0 100.0 &rst iat = 35, 36, 39, 59, r1 = 19.0, r2 = 20.0, r3 = 100.0, r4 = 101.0, &end # 6 GUA GAMMA: (6 DG O5')-(6 DG C5')-(6 DG C4')-(6 DG C3') 20.0 100.0 &rst iat = 165, 166, 169, 189, r1 = 19.0, r2 = 20.0, r3 = 100.0, r4 = 101.0, &end # 11 GUA GAMMA: (11 DG3 O5')-(11 DG3 C5')-(11 DG3 C4')-(11 DG3 C3') 20.0 100.0 &rst iat = 328, 329, 332, 352, r1 = 19.0, r2 = 20.0, r3 = 100.0, r4 = 101.0, &end # 8 GUA GAMMA: (8 DG O5')-(8 DG C5')-(8 DG C4')-(8 DG C3') 20.0 100.0 &rst iat = 230, 231, 234, 254, r1 = 19.0, r2 = 20.0, r3 = 100.0, r4 = 101.0, &end # 3 THY GAMMA: (3 DT O5')-(3 DT C5')-(3 DT C4')-(3 DT C3') 20.0 100.0 &rst iat = 68, 69, 72, 91, r1 = 19.0, r2 = 20.0, r3 = 100.0, r4 = 101.0, &end # 4 THY GAMMA: (4 DT O5')-(4 DT C5')-(4 DT C4')-(4 DT C3') 20.0 100.0 &rst iat = 100, 101, 104, 123, r1 = 19.0, r2 = 20.0, r3 = 100.0, r4 = 101.0, &end # 7 THY GAMMA: (7 DT O5')-(7 DT C5')-(7 DT C4')-(7 DT C3') 20.0 100.0 &rst iat = 198, 199, 202, 221, r1 = 19.0, r2 = 20.0, r3 = 100.0, r4 = 101.0, &end # 9 THY GAMMA: (9 DT O5')-(9 DT C5')-(9 DT C4')-(9 DT C3') 20.0 100.0 &rst iat = 263, 264, 267, 286, r1 = 19.0, r2 = 20.0, r3 = 100.0, r4 = 101.0, &end # 1 GUA CHI: (1 DG5 O4')-(1 DG5 C1')-(1 DG5 N9)-(1 DG5 C4) 45.0 95.0 &rst iat = 8, 9, 11, 25, r1 = 44.0, r2 = 45.0, r3 = 95.0, r4 = 96.0, &end # 2 GUA CHI: (2 DG O4')-(2 DG C1')-(2 DG N9)-(2 DG C4) 200.0 280.0 &rst iat = 41, 42, 44, 58, r1 = 199.0, r2 = 200.0, r3 = 280.0, r4 = 281.0, &end # 5 GUA CHI: (5 DG O4')-(5 DG C1')-(5 DG N9)-(5 DG C4) 45.0 95.0 &rst iat = 138, 139, 141, 155, r1 = 44.0, r2 = 45.0, r3 = 95.0, r4 = 96.0, &end # 6 GUA CHI: (6 DG O4')-(6 DG C1')-(6 DG N9)-(6 DG C4) 200.0 280.0 &rst iat = 171, 172, 174, 188, r1 = 199.0, r2 = 200.0, r3 = 280.0, r4 = 281.0, &end # 10 GUA CHI: (10 DG O4')-(10 DG C1')-(10 DG N9)-(10 DG C4) 45.0 95.0 &rst iat = 301, 302, 304, 318, r1 = 44.0, r2 = 45.0, r3 = 95.0, r4 = 96.0, &end # 11 GUA CHI: (11 DG3 O4')-(11 DG3 C1')-(11 DG3 N9)-(11 DG3 C4) 200.0 280.0 &rst iat = 334, 335, 337, 351, r1 = 199.0, r2 = 200.0, r3 = 280.0, r4 = 281.0, &end # 8 GUA CHI: (8 DG O4')-(8 DG C1')-(8 DG N9)-(8 DG C4) 200.0 280.0 &rst iat = 236, 237, 239, 253, r1 = 199.0, r2 = 200.0, r3 = 280.0, r4 = 281.0, &end # 3 THY CHI: (3 DT O4')-(3 DT C1')-(3 DT N1)-(3 DT C2) 200.0 280.0 &rst iat = 74, 75, 77, 89, r1 = 199.0, r2 = 200.0, r3 = 280.0, r4 = 281.0, &end # 4 THY CHI: (4 DT O4')-(4 DT C1')-(4 DT N1)-(4 DT C2) 200.0 280.0 &rst iat = 106, 107, 109, 121, r1 = 199.0, r2 = 200.0, r3 = 280.0, r4 = 281.0, &end # 7 THY CHI: (7 DT O4')-(7 DT C1')-(7 DT N1)-(7 DT C2) 200.0 280.0 &rst iat = 204, 205, 207, 219, r1 = 199.0, r2 = 200.0, r3 = 280.0, r4 = 281.0, &end # 9 THY CHI: (9 DT O4')-(9 DT C1')-(9 DT N1)-(9 DT C2) 200.0 280.0 &rst iat = 269, 270, 272, 284, r1 = 199.0, r2 = 200.0, r3 = 280.0, r4 = 281.0, &end
Contact the webmaster for help, if required. Friday, May 17, 2024 11:59:25 PM GMT (wattos1)