NMR Restraints Grid

Result table
 (Save to zip file containing files for each block)

image mrblock_id pdb_id cing stage position program type
491296 2hou cing 1-original 1 AMBER dihedral angle


# 811 atoms read from pdb file GXAC_ox_ab_amber.pdb.
# 1 CYT NU7:  (1 DC5 H1')-(1 DC5 C1')-(1 DC5 C2')-(1 DC5 H2'1) 125.0 175.0
 &rst     iat =    10,     9,    25,    26,
   r1 = 124.0, r2 = 125.0, r3 = 175.0, r4 = 176.0,
   rk2 =   200.0, rk3 =  200.0,    /
# 2 CYT NU7:  (2 DC H1')-(2 DC C1')-(2 DC C2')-(2 DC H2'1) 125.0 175.0
 &rst     iat =    40,    39,    55,    56,
   r1 = 124.0, r2 = 125.0, r3 = 175.0, r4 = 176.0,
 /
# 8 ADE NU7:  (8 DA H1')-(8 DA C1')-(8 DA C2')-(8 DA H2'1) 125.0 175.0
 &rst     iat =   220,   219,   237,   238,
   r1 = 124.0, r2 = 125.0, r3 = 175.0, r4 = 176.0,
 /
# 11 GUA NU7:  (11 DG H1')-(11 DG C1')-(11 DG C2')-(11 DG H2'1) 125.0 175.0
 &rst     iat =   312,   311,   330,   331,
   r1 = 124.0, r2 = 125.0, r3 = 175.0, r4 = 176.0,
 /
# 12 GUA NU7:  (12 DG H1')-(12 DG C1')-(12 DG C2')-(12 DG H2'1) 125.0 175.0
 &rst     iat =   345,   344,   363,   364,
   r1 = 124.0, r2 = 125.0, r3 = 175.0, r4 = 176.0,
 /
# 13 GUA NU7:  (13 DG3 H1')-(13 DG3 C1')-(13 DG3 C2')-(13 DG3 H2'1) 125.0 175.0
 &rst     iat =   378,   377,   396,   397,
   r1 = 124.0, r2 = 125.0, r3 = 175.0, r4 = 176.0,
 /
# 17 GUA NU7:  (17 DG H1')-(17 DG C1')-(17 DG C2')-(17 DG H2'1) 125.0 175.0
 &rst     iat =   500,   499,   518,   519,
   r1 = 124.0, r2 = 125.0, r3 = 175.0, r4 = 176.0,
 /
# 18 GUA NU7:  (18 DG H1')-(18 DG C1')-(18 DG C2')-(18 DG H2'1) 125.0 175.0
 &rst     iat =   533,   532,   551,   552,
   r1 = 124.0, r2 = 125.0, r3 = 175.0, r4 = 176.0,
 /
# 24 THY NU7:  (24 DT H1')-(24 DT C1')-(24 DT C2')-(24 DT H2'1) 125.0 175.0
 &rst     iat =   724,   723,   741,   742,
   r1 = 124.0, r2 = 125.0, r3 = 175.0, r4 = 176.0,
 /
# 25 GUA NU7:  (25 DG H1')-(25 DG C1')-(25 DG C2')-(25 DG H2'1) 125.0 175.0
 &rst     iat =   756,   755,   774,   775,
   r1 = 124.0, r2 = 125.0, r3 = 175.0, r4 = 176.0,
 /
# 26 GUA NU7:  (26 DG3 H1')-(26 DG3 C1')-(26 DG3 C2')-(26 DG3 H2'1) 125.0 175.0
 &rst     iat =   789,   788,   807,   808,
   r1 = 124.0, r2 = 125.0, r3 = 175.0, r4 = 176.0,
 /
# 1 CYT NU9:  (1 DC5 H1')-(1 DC5 C1')-(1 DC5 C2')-(1 DC5 H2'2)  20.0  40.0
 &rst     iat =    10,     9,    25,    27,
   r1 =  19.0, r2 =  20.0, r3 =  40.0, r4 =  41.0,
 /
# 2 CYT NU9:  (2 DC H1')-(2 DC C1')-(2 DC C2')-(2 DC H2'2)  20.0  40.0
 &rst     iat =    40,    39,    55,    57,
   r1 =  19.0, r2 =  20.0, r3 =  40.0, r4 =  41.0,
 /
# 8 ADE NU9:  (8 DA H1')-(8 DA C1')-(8 DA C2')-(8 DA H2'2)  20.0  40.0
 &rst     iat =   220,   219,   237,   239,
   r1 =  19.0, r2 =  20.0, r3 =  40.0, r4 =  41.0,
 /
# 12 GUA NU9:  (12 DG H1')-(12 DG C1')-(12 DG C2')-(12 DG H2'2)  20.0  40.0
 &rst     iat =   345,   344,   363,   365,
   r1 =  19.0, r2 =  20.0, r3 =  40.0, r4 =  41.0,
 /
# 13 GUA NU9:  (13 DG3 H1')-(13 DG3 C1')-(13 DG3 C2')-(13 DG3 H2'2)  20.0  40.0
 &rst     iat =   378,   377,   396,   398,
   r1 =  19.0, r2 =  20.0, r3 =  40.0, r4 =  41.0,
 /
# 17 GUA NU9:  (17 DG H1')-(17 DG C1')-(17 DG C2')-(17 DG H2'2)  20.0  40.0
 &rst     iat =   500,   499,   518,   520,
   r1 =  19.0, r2 =  20.0, r3 =  40.0, r4 =  41.0,
 /
# 18 GUA NU9:  (18 DG H1')-(18 DG C1')-(18 DG C2')-(18 DG H2'2)  20.0  40.0
 &rst     iat =   533,   532,   551,   553,
   r1 =  19.0, r2 =  20.0, r3 =  40.0, r4 =  41.0,
 /
#


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