NMR Restraints Grid

Result table
 (Save to zip file containing files for each block)
image mrblock_id pdb_id cing stage position program type
8893 1n0d cing 1-original 4 AMBER dihedral angle 

# start of experimental dihedral angle restraints with rk2=50 rk3=50
#
# 1 C   2 N   2 CA   2 C   -150 -90 
 &rst iat = 5,7,9,15,
        r1=-160., r2=-150., r3=-90., r4=-80., rk2=50., rk3=50., &end
#
# 2 C   3 N   3 CA   3 C   -140 -100 
 &rst iat = 15,17,19,31,
        r1=-150., r2=-140., r3=-100., r4=-90., &end
#
# 3 C   4 N   4 CA   4 C   -179 -1 
 &rst iat = 31,33,35,55,
        r1=-189., r2=-179., r3=-1., r4=9., &end
#
# 4 C   5 N   5 CA   5 C   -150 -90 
 &rst iat = 55,57,59,70,
        r1=-160., r2=-150., r3=-90., r4=-80., &end
#
# 6 C   7 N   7 CA   7 C   -150 -90 
 &rst iat = 77,79,81,91,
        r1=-160., r2=-150., r3=-90., r4=-80., &end
#
# 7 C   8 N   8 CA   8 C   -150 -90 
 &rst iat = 91,93,95,113,
        r1=-160., r2=-150., r3=-90., r4=-80., &end
#
# 8 C   9 N   9 CA   9 C   -179 -1 
 &rst iat = 113,115,117,132,
        r1=-189., r2=-179., r3=-1., r4=9., &end
#
# 9 C   10 N   10 CA   10 C   -140 -100 
 &rst iat = 132,134,136,149,
        r1=-150., r2=-140., r3=-100., r4=-90., &end
#
# 10 C   11 N   11 CA   11 C   -140 -100 
 &rst iat = 149,151,153,159,
        r1=-150., r2=-140., r3=-100., r4=-90., &end
#
# 2 N   2 CA   2 CB   2 SG   -90 -30 
 &rst iat = 7,9,11,14,
        r1=-100., r2=-90., r3=-30., r4=-20., &end
#
# 11 N   11 CA   11 CB   11 SG   -90 -30 
 &rst iat = 151,153,155,158,
        r1=-100., r2=-90., r3=-30., r4=-20., &end
#

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

Contact the webmaster for help, if required. Thursday, April 25, 2024 11:42:50 PM GMT (wattos1)