NMR Restraints Grid

Result table
 (Save to zip file containing files for each block)
image mrblock_id pdb_id cing stage position program type
492184 2k4g cing 1-original 3 AMBER dihedral angle 

# 2 GPN beta:  (2 GPN N1')-(2 GPN C2')-(2 GPN C3')-(2 GPN N4') -70.0 -50.0
 &rst     iat =     7,     9,    12,    15,
   r1 = -71.0, r2 = -70.0, r3 = -50.0, r4 = -49.0,
   rk2 =   2.0, rk3 =   2.0,    &end

# 3 GPN beta:  (3 GPN N1')-(3 GPN C2')-(3 GPN C3')-(3 GPN N4') -70.0 -50.0
 &rst     iat =    41,    43,    46,    49,
   r1 = -71.0, r2 = -70.0, r3 = -50.0, r4 = -49.0,
 &end

# 4 CPN beta:  (4 CPN N1')-(4 CPN C2')-(4 CPN C3')-(4 CPN N4') -70.0 -50.0
 &rst     iat =    75,    77,    80,    83,
   r1 = -71.0, r2 = -70.0, r3 = -50.0, r4 = -49.0,
 &end

# 5 APN beta:  (5 APN N1')-(5 APN C2')-(5 APN C3')-(5 APN N4') -70.0 -50.0
 &rst     iat =   106,   108,   111,   114,
   r1 = -71.0, r2 = -70.0, r3 = -50.0, r4 = -49.0,
 &end

# 6 TPN beta:  (6 TPN N1')-(6 TPN C2')-(6 TPN C3')-(6 TPN N4') -70.0 -50.0
 &rst     iat =   139,   141,   144,   147,
   r1 = -71.0, r2 = -70.0, r3 = -50.0, r4 = -49.0,
 &end

# 7 GPN beta:  (7 GPN N1')-(7 GPN C2')-(7 GPN C3')-(7 GPN N4') -70.0 -50.0
 &rst     iat =   172,   174,   177,   180,
   r1 = -71.0, r2 = -70.0, r3 = -50.0, r4 = -49.0,
 &end

# 8 CPN beta:  (8 CPN N1')-(8 CPN C2')-(8 CPN C3')-(8 CPN N4') -70.0 -50.0
 &rst     iat =   206,   208,   211,   214,
   r1 = -71.0, r2 = -70.0, r3 = -50.0, r4 = -49.0,
 &end

# 9 CPN beta:  (9 CPN N1')-(9 CPN C2')-(9 CPN C3')-(9 CPN N4') -70.0 -50.0
 &rst     iat =   237,   239,   242,   245,
   r1 = -71.0, r2 = -70.0, r3 = -50.0, r4 = -49.0,
 &end

# 12 GPN beta:  (12 GPN N1')-(12 GPN C2')-(12 GPN C3')-(12 GPN N4') -70.0 -50.0
 &rst     iat =   280,   282,   285,   288,
   r1 = -71.0, r2 = -70.0, r3 = -50.0, r4 = -49.0,
 &end

# 13 GPN beta:  (13 GPN N1')-(13 GPN C2')-(13 GPN C3')-(13 GPN N4') -70.0 -50.0
 &rst     iat =   314,   316,   319,   322,
   r1 = -71.0, r2 = -70.0, r3 = -50.0, r4 = -49.0,
 &end

# 14 CPN beta:  (14 CPN N1')-(14 CPN C2')-(14 CPN C3')-(14 CPN N4') -70.0 -50.0
 &rst     iat =   348,   350,   353,   356,
   r1 = -71.0, r2 = -70.0, r3 = -50.0, r4 = -49.0,
 &end

# 15 APN beta:  (15 APN N1')-(15 APN C2')-(15 APN C3')-(15 APN N4') -70.0 -50.0
 &rst     iat =   379,   381,   384,   387,
   r1 = -71.0, r2 = -70.0, r3 = -50.0, r4 = -49.0,
 &end

Please acknowledge these references in publications where the data from this site have been utilized.

Contact the webmaster for help, if required. Friday, May 3, 2024 8:36:13 PM GMT (wattos1)