NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type | subtype | subsubtype |
27092 | 2ozx | 6625 | cing | 1-original | 2 | AMBER | distance | NOE | ambi |
# # 52 TYR HB- 52 TYR HD 3.5 (# 0:25 Unique) &rst ixpk= 0, nxpk= 25, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91, rk2=20.0, rk3=20.0, ir6=1, ialtd=0, igr1= 787, 788, igr2= 791, 800, &end # # 52 TYR HB+ 52 TYR HD 3.5 (# 1:25 Unique) &rst ixpk= 1, nxpk= 25, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91, igr1= 787, 788, igr2= 791, 800, &end # # 52 TYR HA 52 TYR HD 4.5 (# 2:25 Unique) &rst ixpk= 2, nxpk= 25, iat= 785, -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55, igr2= 791, 800, &end # # 0 AMB 25-2:3 52 TYR HD 4.5 (# 3:25 Single) &rst ixpk= 3, nxpk= 25, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.36, r4= 6.86, igr1= 775, 776, 772, 773, igr2= 791, 800, &end # # 51 GLU HB- 52 TYR HD 4.5 (# 4:25 Unique) &rst ixpk= 4, nxpk= 25, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17, igr1= 772, 773, igr2= 791, 800, &end # # 52 TYR HE 52 TYR HD 2.8 (# 5:25 Unique) &rst ixpk= 5, nxpk= 25, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 3.53, r4= 4.03, igr1= 793, 798, igr2= 791, 800, &end # # 52 TYR HN 52 TYR HD 4.5 (# 6:25 Unique) &rst ixpk= 6, nxpk= 25, iat= 783, -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55, igr2= 791, 800, &end # # 0 AMB 25-2:7 93 TYR HD 4.5 (# 7:25 Single) &rst ixpk= 7, nxpk= 25, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.36, r4= 6.86, igr1=1399,1400,1489,1490, igr2=1403,1412, &end # # 93 TYR HB+ 93 TYR HD 5.5 (# 8:25 Unique) &rst ixpk= 8, nxpk= 25, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43, igr1=1399,1400, igr2=1403,1412, &end # # 57 TYR HA 57 TYR HD 4.5 (# 9:25 Unique) &rst ixpk= 9, nxpk= 25, iat= 864, -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55, igr2= 870, 879, &end # # 57 TYR HE 57 TYR HD 3.5 (# 11:25 Unique) &rst ixpk= 11, nxpk= 25, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91, igr1= 872, 877, igr2= 870, 879, &end # # 97 TYR HA 97 TYR HD 3.5 (# 12:25 Unique) &rst ixpk= 12, nxpk= 25, iat=1456, -1, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43, igr2=1462,1471, &end # # 57 TYR HB3 57 TYR HD 4.5 (# 13:25 Unique) &rst ixpk= 13, nxpk= 25, iat= 867, -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55, igr2= 870, 879, &end # # 57 TYR HB2 57 TYR HD 4.5 (# 14:25 Unique) &rst ixpk= 14, nxpk= 25, iat= 866, -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55, igr2= 870, 879, &end # # 97 TYR HB+ 97 TYR HD 3.5 (# 15:25 Unique) &rst ixpk= 15, nxpk= 25, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91, igr1=1458,1459, igr2=1462,1471, &end # # 97 TYR HB- 97 TYR HD 4.5 (# 16:25 Unique) &rst ixpk= 16, nxpk= 25, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17, igr1=1458,1459, igr2=1462,1471, &end # # 73 CYS HB+ 57 TYR HD 7.0 (# 17:25 Unique) &rst ixpk= 17, nxpk= 25, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 8.82, r4= 9.32, igr1=1096,1097, igr2= 870, 879, &end # # 25 ILE HG1- 57 TYR HD 5.5 (# 18:25 Unique) &rst ixpk= 18, nxpk= 25, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43, igr1= 375, 376, igr2= 870, 879, &end # # 0 AMB 25-2:19 57 TYR HD 3.5 (# 19:25 Single) &rst ixpk= 19, nxpk= 25, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80, igr1= 378, 379, 380, 371, 372, 373, igr2= 870, 879, &end # # 0 AMB 25-2:20 97 TYR HD 4.5 (# 20:25 Single) &rst ixpk= 20, nxpk= 25, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 7.64, r4= 8.14, igr1= 336, 337, 338, 340, 341, 342, 336, 337, 338, 340, 341, 342, igr2=1462,1471, &end # # 97 TYR HE 97 TYR HD 3.5 (# 21:25 Unique) &rst ixpk= 21, nxpk= 25, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91, igr1=1464,1469, igr2=1462,1471, &end # # 0 AMB 25-2:22 97 TYR HD 7.0 (# 22:25 Single) &rst ixpk= 22, nxpk= 25, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 9.90, r4=10.40, igr1=1131,1132, 808, 809, igr2=1462,1471, &end # # 91 TYR HN 91 TYR HD 4.5 (# 23:25 Unique) &rst ixpk= 23, nxpk= 25, iat=1367, -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55, igr2=1375,1384, &end # # 92 GLY HN 91 TYR HD 5.5 (# 24:25 Unique) &rst ixpk= 24, nxpk= 25, iat=1388, -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67, igr2=1375,1384, &end # # 91 TYR HE 91 TYR HD 2.8 (# 25:25 Unique) &rst ixpk= 25, nxpk= 25, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 3.53, r4= 4.03, igr1=1377,1382, igr2=1375,1384, &end # # 0 AMB 25-2:27 91 TYR HD 7.0 (# 27:25 Single) &rst ixpk= 27, nxpk= 25, iat= -1, -1, r1= 1.30, r2= 1.80, r3=10.59, r4=11.09, igr1=1879,1880,1190,1191,1190,1191, igr2=1375,1384, &end # # 91 TYR HB- 91 TYR HD 4.5 (# 28:25 Unique) &rst ixpk= 28, nxpk= 25, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17, igr1=1371,1372, igr2=1375,1384, &end # # 91 TYR HB+ 91 TYR HD 5.5 (# 29:25 Unique) &rst ixpk= 29, nxpk= 25, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43, igr1=1371,1372, igr2=1375,1384, &end # # 0 AMB 25-2:30 47 TYR HD 3.5 (# 30:25 Single) &rst ixpk= 30, nxpk= 25, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80, igr1= 762, 763, 764, 856, 857, 858, igr2= 699, 708, &end # # 0 AMB 25-2:31 47 TYR HD 7.0 (# 31:25 Single) &rst ixpk= 31, nxpk= 25, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 8.82, r4= 9.32, igr1= 760, 714, igr2= 699, 708, &end # # 47 TYR HE 47 TYR HD 3.5 (# 32:25 Unique) &rst ixpk= 32, nxpk= 25, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91, igr1= 701, 706, igr2= 699, 708, &end # # 49 TRP HE1 49 TRP HD1 3.5 (# 33:25 Unique) &rst ixpk= 33, nxpk= 25, iat= 744, 742, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00, &end # # 49 TRP HA 49 TRP HD1 7.0 (# 34:25 Unique) &rst ixpk= 34, nxpk= 25, iat= 736, 742, r1= 1.30, r2= 1.80, r3= 7.00, r4= 7.50, &end # # 49 TRP HB+ 49 TRP HD1 5.5 (# 35:25 Unique) &rst ixpk= 35, nxpk= 25, iat= -1, 742, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67, igr1= 738, 739, &end # # 49 TRP HB- 49 TRP HD1 4.5 (# 36:25 Unique) &rst ixpk= 36, nxpk= 25, iat= -1, 742, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55, igr1= 738, 739, &end # # 120 TRP HE1 120 TRP HD1 3.5 (# 38:25 Unique) &rst ixpk= 38, nxpk= 25, iat=1827,1825, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00, &end # # 120 TRP HN 120 TRP HD1 5.5 (# 39:25 Unique) &rst ixpk= 39, nxpk= 25, iat=1817,1825, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end # # 106 THR HB 120 TRP HD1 5.5 (# 40:25 Unique) &rst ixpk= 40, nxpk= 25, iat=1584,1825, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end # # 0 AMB 25-2:41 120 TRP HD1 4.5 (# 41:25 Single) &rst ixpk= 41, nxpk= 25, iat= -1,1825, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90, igr1=1821,1822,1542, &end # # 106 THR MG2 120 TRP HD1 3.5 (# 42:25 Unique) &rst ixpk= 42, nxpk= 25, iat= -1,1825, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70, igr1=1586,1587,1588, &end # # 0 AMB 25-2:43 120 TRP HD1 7.0 (# 43:25 Single) &rst ixpk= 43, nxpk= 25, iat= -1,1825, r1= 1.30, r2= 1.80, r3=10.99, r4=11.49, igr1=1793,1794,1795,1797,1798,1799,1793,1794,1795,1797, 1798,1799,1544,1545,1546, &end # # 120 TRP HZ2 120 TRP HH2 2.8 (# 44:25 Unique) &rst ixpk= 44, nxpk= 25, iat=1830,1832, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30, &end # # 103 ALA MB 120 TRP HH2 7.0 (# 45:25 Unique) &rst ixpk= 45, nxpk= 25, iat= -1,1832, r1= 1.30, r2= 1.80, r3= 8.41, r4= 8.91, igr1=1544,1545,1546, &end # # 59 LYS HG+ 49 TRP HH2 7.0 (# 46:25 Unique) &rst ixpk= 46, nxpk= 25, iat= -1, 749, r1= 1.30, r2= 1.80, r3= 7.86, r4= 8.36, igr1= 902, 903, &end # # 0 AMB 25-2:47 49 TRP HH2 5.5 (# 47:25 Single) &rst ixpk= 47, nxpk= 25, iat= -1, 749, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43, igr1= 899, 900, 899, 900, &end # # 0 AMB 25-2:48 49 TRP HH2 7.0 (# 48:25 Single) &rst ixpk= 48, nxpk= 25, iat= -1, 749, r1= 1.30, r2= 1.80, r3= 9.44, r4= 9.94, igr1= 849, 850, 851, 762, 763, 764, &end # # 56 ILE HA 49 TRP HH2 7.0 (# 49:25 Unique) &rst ixpk= 49, nxpk= 25, iat= 845, 749, r1= 1.30, r2= 1.80, r3= 7.00, r4= 7.50, &end # # 49 TRP HZ2 49 TRP HH2 3.5 (# 50:25 Unique) &rst ixpk= 50, nxpk= 25, iat= 747, 749, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00, &end # # 102 HIS HB2 120 TRP HE3 7.0 (# 51:25 Unique) &rst ixpk= 51, nxpk= 25, iat=1527,1836, r1= 1.30, r2= 1.80, r3= 7.00, r4= 7.50, &end # # 0 AMB 25-2:52 120 TRP HE3 5.5 (# 52:25 Single) &rst ixpk= 52, nxpk= 25, iat= -1,1836, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11, igr1=1855,1856,1528, &end # # 0 AMB 25-2:54 120 TRP HE3 4.5 (# 54:25 Single) &rst ixpk= 54, nxpk= 25, iat= -1,1836, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55, igr1=1853,1369, &end # # 120 TRP HZ3 120 TRP HE3 5.5 (# 55:25 Unique) &rst ixpk= 55, nxpk= 25, iat=1834,1836, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end # # 102 HIS HN 120 TRP HE3 7.0 (# 56:25 Unique) &rst ixpk= 56, nxpk= 25, iat=1523,1836, r1= 1.30, r2= 1.80, r3= 7.00, r4= 7.50, &end # # 71 CYS HA 28 HIS HD2 7.0 (# 58:25 Unique) &rst ixpk= 58, nxpk= 25, iat=1068, 437, r1= 1.30, r2= 1.80, r3= 7.00, r4= 7.50, &end # # 27 VAL HA 28 HIS HD2 5.5 (# 59:25 Unique) &rst ixpk= 59, nxpk= 25, iat= 410, 437, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end # # 28 HIS HB3 28 HIS HD2 7.0 (# 60:25 Unique) &rst ixpk= 60, nxpk= 25, iat= 429, 437, r1= 1.30, r2= 1.80, r3= 7.00, r4= 7.50, &end # # 0 AMB 25-2:61 28 HIS HD2 7.0 (# 61:25 Single) &rst ixpk= 61, nxpk= 25, iat= -1, 437, r1= 1.30, r2= 1.80, r3= 7.86, r4= 8.36, igr1= 424,1077, &end # # 125 TYR HE 125 TYR HB- 4.5 (# 62:25 Single) &rst ixpk= 62, nxpk= 25, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17, igr1=1894,1899, igr2=1888,1889, &end # # 125 TYR HE 125 TYR HB- 4.5 (# 63:25 Single) &rst ixpk= 63, nxpk= 25, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17, igr1=1894,1899, igr2=1888,1889, &end # # 125 TYR HE 125 TYR HA 7.0 (# 64:25 Single) &rst ixpk= 64, nxpk= 25, iat= -1,1886, r1= 1.30, r2= 1.80, r3= 7.86, r4= 8.36, igr1=1894,1899, &end # # 95 MET HG+ 93 TYR HE 4.5 (# 67:25 Unique) &rst ixpk= 67, nxpk= 25, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17, igr1=1434,1435, igr2=1405,1410, &end # # 125 TYR HB+ 93 TYR HE 5.5 (# 68:25 Unique) &rst ixpk= 68, nxpk= 25, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43, igr1=1888,1889, igr2=1405,1410, &end # # 95 MET HA 93 TYR HE 5.5 (# 69:25 Unique) &rst ixpk= 69, nxpk= 25, iat=1429, -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67, igr2=1405,1410, &end # # 0 AMB 25-2:70 0 AMB 25-1:70 4.5 (# 70:25 Double) &rst ixpk= 70, nxpk= 25, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 7.07, r4= 7.57, igr1= 825, 826, 827, 350, 351, igr2=1464,1469,1536, &end # # 53 HIS HB+ 97 TYR HE 5.5 (# 71:25 Unique) &rst ixpk= 71, nxpk= 25, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43, igr1= 808, 809, igr2=1464,1469, &end # # 53 HIS HB- 97 TYR HE 7.0 (# 72:25 Unique) &rst ixpk= 72, nxpk= 25, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 8.82, r4= 9.32, igr1= 808, 809, igr2=1464,1469, &end # # 0 AMB 25-2:73 97 TYR HE 3.5 (# 73:25 Single) &rst ixpk= 73, nxpk= 25, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.94, r4= 6.44, igr1= 336, 337, 338, 340, 341, 342, 336, 337, 338, 340, 341, 342, igr2=1464,1469, &end # # 0 AMB 25-2:74 0 AMB 25-1:74 3.5 (# 74:25 Double) &rst ixpk= 74, nxpk= 25, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17, igr1=1500,1501,1502,1448,1449,1450, igr2=1536,1464,1469, &end # # 0 AMB 25-2:75 91 TYR HE 4.5 (# 75:25 Single) &rst ixpk= 75, nxpk= 25, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.36, r4= 6.86, igr1=1190,1191,1190,1191, igr2=1377,1382, &end # # 19 VAL MGX 91 TYR HE 4.5 (# 76:25 Unique) &rst ixpk= 76, nxpk= 25, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31, igr1= 257, 258, 259, 261, 262, 263, igr2=1377,1382, &end # # 0 AMB 25-2:78 22 TYR HE 7.0 (# 78:25 Single) &rst ixpk= 78, nxpk= 25, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 9.44, r4= 9.94, igr1= 332,1169, 289, igr2= 319, 324, &end # # 24 LEU MDY 22 TYR HE 3.5 (# 80:25 Unique) &rst ixpk= 80, nxpk= 25, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80, igr1= 355, 356, 357, 359, 360, 361, igr2= 319, 324, &end # # 49 TRP HE3 49 TRP HZ3 7.0 (# 81:25 Unique) &rst ixpk= 81, nxpk= 25, iat= 753, 751, r1= 1.30, r2= 1.80, r3= 7.00, r4= 7.50, &end # # 49 TRP HZ3 49 TRP HE3 7.0 (# 82:25 Unique) &rst ixpk= 82, nxpk= 25, iat= 751, 753, r1= 1.30, r2= 1.80, r3= 7.00, r4= 7.50, &end # # 0 AMB 25-2:84 28 HIS HE1 4.5 (# 84:25 Single) &rst ixpk= 84, nxpk= 25, iat= -1, 434, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17, igr1= 394, 395, 394, 395, &end # # 26 ARG HG+ 28 HIS HE1 7.0 (# 85:25 Unique) &rst ixpk= 85, nxpk= 25, iat= -1, 434, r1= 1.30, r2= 1.80, r3= 7.86, r4= 8.36, igr1= 391, 392, &end # # 41 LYS HN 28 HIS HE1 7.0 (# 86:25 Unique) &rst ixpk= 86, nxpk= 25, iat= 588, 434, r1= 1.30, r2= 1.80, r3= 7.00, r4= 7.50, &end # # 121 ALA MB 89 HIS HE1 3.5 (# 87:25 Unique) &rst ixpk= 87, nxpk= 25, iat= -1,1344, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70, igr1=1845,1846,1847, &end # # 119 THR HB 89 HIS HE1 5.5 (# 88:25 Unique) &rst ixpk= 88, nxpk= 25, iat=1807,1344, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end # # 120 TRP HA 89 HIS HE1 5.5 (# 90:25 Unique) &rst ixpk= 90, nxpk= 25, iat=1819,1344, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end # # 120 TRP HN 89 HIS HE1 7.0 (# 91:25 Unique) &rst ixpk= 91, nxpk= 25, iat=1817,1344, r1= 1.30, r2= 1.80, r3= 7.00, r4= 7.50, &end # # 121 ALA HN 89 HIS HE1 7.0 (# 92:25 Unique) &rst ixpk= 92, nxpk= 25, iat=1841,1344, r1= 1.30, r2= 1.80, r3= 7.00, r4= 7.50, &end # # 0 AMB 25-2:93 89 HIS HE1 5.5 (# 93:25 Single) &rst ixpk= 93, nxpk= 25, iat= -1,1344, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67, igr1=1843,1353, &end # # 28 HIS HB2 28 HIS HD2 7.0 (# 107:25 Unique) &rst ixpk= 107, nxpk= 25, iat= 428, 437, r1= 1.30, r2= 1.80, r3= 7.00, r4= 7.50, &end # # 28 HIS HA 28 HIS HD2 7.0 (# 108:25 Unique) &rst ixpk= 108, nxpk= 25, iat= 426, 437, r1= 1.30, r2= 1.80, r3= 7.00, r4= 7.50, &end # # 0 AMB 25-2:110 52 TYR HD 7.0 (# 110:25 Single) &rst ixpk= 110, nxpk= 25, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 9.44, r4= 9.94, igr1= 836, 808, 809, igr2= 791, 800, &end
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