NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | cing | stage | position | program | type | subtype | subsubtype |
492654 | 2kqo | cing | 1-original | 1 | AMBER | distance | NOE | simple |
# # 2 3VB H2N 3 4ZB H1 2.80000 3.80000 &rst ixpk= 0, nxpk= 0, iat= 22, 31, r1= 2.30, r2= 2.80, r3= 3.80, r4= 4.30, rk2=10.0, rk3=10.0, ir6=1, ialtd=0, &end # # 2 3VB H3 3 4ZB H1 1.80000 2.70000 &rst ixpk= 0, nxpk= 0, iat= 18, 31, r1= 1.30, r2= 1.80, r3= 2.70, r4= 3.20, &end # # 3 4ZB H4 4 3VB H1 1.80000 2.70000 &rst ixpk= 0, nxpk= 0, iat= 39, 50, r1= 1.30, r2= 1.80, r3= 2.70, r4= 3.20, &end # # 4 3VB H2N 5 4ZB H1 2.80000 3.80000 &rst ixpk= 0, nxpk= 0, iat= 68, 77, r1= 2.30, r2= 2.80, r3= 3.80, r4= 4.30, &end # # 4 3VB H3 5 4ZB H1 1.80000 2.70000 &rst ixpk= 0, nxpk= 0, iat= 64, 77, r1= 1.30, r2= 1.80, r3= 2.70, r4= 3.20, &end # # 5 4ZB H4 6 3VB H1 1.80000 2.70000 &rst ixpk= 0, nxpk= 0, iat= 85, 96, r1= 1.30, r2= 1.80, r3= 2.70, r4= 3.20, &end # # 6 3VB H2N 7 0ZB H1 2.80000 3.80000 &rst ixpk= 0, nxpk= 0, iat= 114, 123, r1= 2.30, r2= 2.80, r3= 3.80, r4= 4.30, &end # # 6 3VB H3 7 0ZB H1 1.80000 2.70000 &rst ixpk= 0, nxpk= 0, iat= 110, 123, r1= 1.30, r2= 1.80, r3= 2.70, r4= 3.20, &end # 141 atoms read from pdb file gag.pdb. # 2 3VB T1: (2 3VB C1)-(2 3VB C2)-(2 3VB C3)-(2 3VB C4) -410.0 -70.0 &rst iat = 3, 19, 17, 13, r1 = -411.0, r2 = -410.0, r3 = -70.0, r4 = -69.0, rk2 = 100.0, rk3 = 100.0, &end # 2 3VB T2: (2 3VB C2)-(2 3VB C3)-(2 3VB C4)-(2 3VB C5) 50.0 70.0 &rst iat = 19, 17, 13, 6, r1 = 49.0, r2 = 50.0, r3 = 70.0, r4 = 71.0, &end # 2 3VB T3: (2 3VB C3)-(2 3VB C4)-(2 3VB C5)-(2 3VB O5) -410.0 -70.0 &rst iat = 17, 13, 6, 5, r1 = -411.0, r2 = -410.0, r3 = -70.0, r4 = -69.0, &end # 2 3VB T4: (2 3VB C4)-(2 3VB C5)-(2 3VB O5)-(2 3VB C1) 50.0 70.0 &rst iat = 13, 6, 5, 3, r1 = 49.0, r2 = 50.0, r3 = 70.0, r4 = 71.0, &end # 2 3VB T5: (2 3VB C5)-(2 3VB O5)-(2 3VB C1)-(2 3VB C2) -410.0 -70.0 &rst iat = 6, 5, 3, 19, r1 = -411.0, r2 = -410.0, r3 = -70.0, r4 = -69.0, &end # 2 3VB T6: (2 3VB O5)-(2 3VB C1)-(2 3VB C2)-(2 3VB C3) 50.0 70.0 &rst iat = 5, 3, 19, 17, r1 = 49.0, r2 = 50.0, r3 = 70.0, r4 = 71.0, &end # 2 3VB T6: (2 3VB O5)-(2 3VB C1)-(2 3VB C2)-(2 3VB C3) 50.0 70.0 &rst iat = 5, 3, 19, 17, r1 = 49.0, r2 = 50.0, r3 = 70.0, r4 = 71.0, &end # 3 4ZB T1: (3 4ZB C1)-(3 4ZB C2)-(3 4ZB C3)-(3 4ZB C4) -410.0 -70.0 &rst iat = 30, 44, 40, 38, r1 = -411.0, r2 = -410.0, r3 = -70.0, r4 = -69.0, &end # 3 4ZB T2: (3 4ZB C2)-(3 4ZB C3)-(3 4ZB C4)-(3 4ZB C5) 50.0 70.0 &rst iat = 44, 40, 38, 33, r1 = 49.0, r2 = 50.0, r3 = 70.0, r4 = 71.0, &end # 3 4ZB T3: (3 4ZB C3)-(3 4ZB C4)-(3 4ZB C5)-(3 4ZB O5) -410.0 -70.0 &rst iat = 40, 38, 33, 32, r1 = -411.0, r2 = -410.0, r3 = -70.0, r4 = -69.0, &end # 3 4ZB T4: (3 4ZB C4)-(3 4ZB C5)-(3 4ZB O5)-(3 4ZB C1) 50.0 70.0 &rst iat = 38, 33, 32, 30, r1 = 49.0, r2 = 50.0, r3 = 70.0, r4 = 71.0, &end # 3 4ZB T5: (3 4ZB C5)-(3 4ZB O5)-(3 4ZB C1)-(3 4ZB C2) -410.0 -70.0 &rst iat = 33, 32, 30, 44, r1 = -411.0, r2 = -410.0, r3 = -70.0, r4 = -69.0, &end # 3 4ZB T6: (3 4ZB O5)-(3 4ZB C1)-(3 4ZB C2)-(3 4ZB C3) 50.0 70.0 &rst iat = 32, 30, 44, 40, r1 = 49.0, r2 = 50.0, r3 = 70.0, r4 = 71.0, &end # 3 4ZB T6: (3 4ZB O5)-(3 4ZB C1)-(3 4ZB C2)-(3 4ZB C3) 50.0 70.0 &rst iat = 32, 30, 44, 40, r1 = 49.0, r2 = 50.0, r3 = 70.0, r4 = 71.0, &end # 4 3VB T1: (4 3VB C1)-(4 3VB C2)-(4 3VB C3)-(4 3VB C4) -410.0 -70.0 &rst iat = 49, 65, 63, 59, r1 = -411.0, r2 = -410.0, r3 = -70.0, r4 = -69.0, &end # 4 3VB T2: (4 3VB C2)-(4 3VB C3)-(4 3VB C4)-(4 3VB C5) 50.0 70.0 &rst iat = 65, 63, 59, 52, r1 = 49.0, r2 = 50.0, r3 = 70.0, r4 = 71.0, &end # 4 3VB T3: (4 3VB C3)-(4 3VB C4)-(4 3VB C5)-(4 3VB O5) -410.0 -70.0 &rst iat = 63, 59, 52, 51, r1 = -411.0, r2 = -410.0, r3 = -70.0, r4 = -69.0, &end # 4 3VB T4: (4 3VB C4)-(4 3VB C5)-(4 3VB O5)-(4 3VB C1) 50.0 70.0 &rst iat = 59, 52, 51, 49, r1 = 49.0, r2 = 50.0, r3 = 70.0, r4 = 71.0, &end # 4 3VB T5: (4 3VB C5)-(4 3VB O5)-(4 3VB C1)-(4 3VB C2) -410.0 -70.0 &rst iat = 52, 51, 49, 65, r1 = -411.0, r2 = -410.0, r3 = -70.0, r4 = -69.0, &end # 4 3VB T6: (4 3VB O5)-(4 3VB C1)-(4 3VB C2)-(4 3VB C3) 50.0 70.0 &rst iat = 51, 49, 65, 63, r1 = 49.0, r2 = 50.0, r3 = 70.0, r4 = 71.0, &end # 4 3VB T6: (4 3VB O5)-(4 3VB C1)-(4 3VB C2)-(4 3VB C3) 50.0 70.0 &rst iat = 51, 49, 65, 63, r1 = 49.0, r2 = 50.0, r3 = 70.0, r4 = 71.0, &end # 5 4ZB T1: (5 4ZB C1)-(5 4ZB C2)-(5 4ZB C3)-(5 4ZB C4) -410.0 -70.0 &rst iat = 76, 90, 86, 84, r1 = -411.0, r2 = -410.0, r3 = -70.0, r4 = -69.0, &end # 5 4ZB T2: (5 4ZB C2)-(5 4ZB C3)-(5 4ZB C4)-(5 4ZB C5) 50.0 70.0 &rst iat = 90, 86, 84, 79, r1 = 49.0, r2 = 50.0, r3 = 70.0, r4 = 71.0, &end # 5 4ZB T3: (5 4ZB C3)-(5 4ZB C4)-(5 4ZB C5)-(5 4ZB O5) -410.0 -70.0 &rst iat = 86, 84, 79, 78, r1 = -411.0, r2 = -410.0, r3 = -70.0, r4 = -69.0, &end # 5 4ZB T4: (5 4ZB C4)-(5 4ZB C5)-(5 4ZB O5)-(5 4ZB C1) 50.0 70.0 &rst iat = 84, 79, 78, 76, r1 = 49.0, r2 = 50.0, r3 = 70.0, r4 = 71.0, &end # 5 4ZB T5: (5 4ZB C5)-(5 4ZB O5)-(5 4ZB C1)-(5 4ZB C2) -410.0 -70.0 &rst iat = 79, 78, 76, 90, r1 = -411.0, r2 = -410.0, r3 = -70.0, r4 = -69.0, &end # 5 4ZB T6: (5 4ZB O5)-(5 4ZB C1)-(5 4ZB C2)-(5 4ZB C3) 50.0 70.0 &rst iat = 78, 76, 90, 86, r1 = 49.0, r2 = 50.0, r3 = 70.0, r4 = 71.0, &end # 5 4ZB T6: (5 4ZB O5)-(5 4ZB C1)-(5 4ZB C2)-(5 4ZB C3) 50.0 70.0 &rst iat = 78, 76, 90, 86, r1 = 49.0, r2 = 50.0, r3 = 70.0, r4 = 71.0, &end # 6 3VB T1: (6 3VB C1)-(6 3VB C2)-(6 3VB C3)-(6 3VB C4) -410.0 -70.0 &rst iat = 95, 111, 109, 105, r1 = -411.0, r2 = -410.0, r3 = -70.0, r4 = -69.0, &end # 6 3VB T2: (6 3VB C2)-(6 3VB C3)-(6 3VB C4)-(6 3VB C5) 50.0 70.0 &rst iat = 111, 109, 105, 98, r1 = 49.0, r2 = 50.0, r3 = 70.0, r4 = 71.0, &end # 6 3VB T3: (6 3VB C3)-(6 3VB C4)-(6 3VB C5)-(6 3VB O5) -410.0 -70.0 &rst iat = 109, 105, 98, 97, r1 = -411.0, r2 = -410.0, r3 = -70.0, r4 = -69.0, &end # 6 3VB T4: (6 3VB C4)-(6 3VB C5)-(6 3VB O5)-(6 3VB C1) 50.0 70.0 &rst iat = 105, 98, 97, 95, r1 = 49.0, r2 = 50.0, r3 = 70.0, r4 = 71.0, &end # 6 3VB T5: (6 3VB C5)-(6 3VB O5)-(6 3VB C1)-(6 3VB C2) -410.0 -70.0 &rst iat = 98, 97, 95, 111, r1 = -411.0, r2 = -410.0, r3 = -70.0, r4 = -69.0, &end # 6 3VB T6: (6 3VB O5)-(6 3VB C1)-(6 3VB C2)-(6 3VB C3) 50.0 70.0 &rst iat = 97, 95, 111, 109, r1 = 49.0, r2 = 50.0, r3 = 70.0, r4 = 71.0, &end # 6 3VB T6: (6 3VB O5)-(6 3VB C1)-(6 3VB C2)-(6 3VB C3) 50.0 70.0 &rst iat = 97, 95, 111, 109, r1 = 49.0, r2 = 50.0, r3 = 70.0, r4 = 71.0, &end # 7 0ZB T1: (7 0ZB C1)-(7 0ZB C2)-(7 0ZB C3)-(7 0ZB C4) -410.0 -70.0 &rst iat = 122, 138, 134, 130, r1 = -411.0, r2 = -410.0, r3 = -70.0, r4 = -69.0, &end # 7 0ZB T2: (7 0ZB C2)-(7 0ZB C3)-(7 0ZB C4)-(7 0ZB C5) 50.0 70.0 &rst iat = 138, 134, 130, 125, r1 = 49.0, r2 = 50.0, r3 = 70.0, r4 = 71.0, &end # 7 0ZB T3: (7 0ZB C3)-(7 0ZB C4)-(7 0ZB C5)-(7 0ZB O5) -410.0 -70.0 &rst iat = 134, 130, 125, 124, r1 = -411.0, r2 = -410.0, r3 = -70.0, r4 = -69.0, &end # 7 0ZB T4: (7 0ZB C4)-(7 0ZB C5)-(7 0ZB O5)-(7 0ZB C1) 50.0 70.0 &rst iat = 130, 125, 124, 122, r1 = 49.0, r2 = 50.0, r3 = 70.0, r4 = 71.0, &end # 7 0ZB T5: (7 0ZB C5)-(7 0ZB O5)-(7 0ZB C1)-(7 0ZB C2) -410.0 -70.0 &rst iat = 125, 124, 122, 138, r1 = -411.0, r2 = -410.0, r3 = -70.0, r4 = -69.0, &end # 7 0ZB T6: (7 0ZB O5)-(7 0ZB C1)-(7 0ZB C2)-(7 0ZB C3) 50.0 70.0 &rst iat = 124, 122, 138, 134, r1 = 49.0, r2 = 50.0, r3 = 70.0, r4 = 71.0, &end
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