BMRB

NMR Restraints Grid

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

image mrblock_id pdb_id bmrb_id cing stage position program type
627915 5o4d RC 34145 cing 1-original 1 AMBER planarity 

# Restraints file 1: ang.rst
###### PLANARITY RESTRAINTS ###########
# 1st QUARTET: 2-6-20-12
#
# 2-6
#  planarity restraint:  N9 N7 N1 N3
 &rst iat=2,2,6,6, atnam(1)='N9', atnam(2)='N7',
     atnam(3)='N1', atnam(4)='N3',
     r1=350.0, r2=355.0, r3=365.0, r4=370.0,
     rk2=20.0, rk3=20.0, nstep1=50000, nstep2=290000, iresid=1, &end

#  planarity restraint:  C5 C2 N7 C4
 &rst iat=2,2,6,6, atnam(1)='C5', atnam(2)='C2',
     atnam(3)='N7', atnam(4)='C4',
     r1=350.0, r2=355.0, r3=365.0, r4=370.0,
     rk2=20.0, rk3=20.0, nstep1=50000, nstep2=290000, iresid=1, &end

#  planarity restraint:  C2 C8 C2 C8
 &rst iat=2,2,6,6, atnam(1)='C2', atnam(2)='C8',
     atnam(3)='C2', atnam(4)='C8',
     r1=350.0, r2=355.0, r3=365.0, r4=370.0,
     rk2=20.0, rk3=20.0, nstep1=50000, nstep2=290000, iresid=1, &end

# 6-20
#  planarity restraints:  N9 N7 N1 N3
 &rst iat=6,6,20,20, atnam(1)='N9', atnam(2)='N7',
     atnam(3)='N1', atnam(4)='N3',
     r1=350.0, r2=355.0, r3=365.0, r4=370.0,
     rk2=20.0, rk3=20.0, nstep1=50000, nstep2=290000, iresid=1, &end

#  planarity restraint:  C5 C2 N7 C4
 &rst iat=6,6,20,20, atnam(1)='C5', atnam(2)='C2',
     atnam(3)='N7', atnam(4)='C4',
     r1=350.0, r2=355.0, r3=365.0, r4=370.0,
     rk2=20.0, rk3=20.0, nstep1=50000, nstep2=290000, iresid=1, &end

#  planarity restraint:  C2 C8 C2 C8
 &rst iat=6,6,20,20, atnam(1)='C2', atnam(2)='C8',
     atnam(3)='C2', atnam(4)='C8',
     r1=350.0, r2=355.0, r3=365.0, r4=370.0,
     rk2=20.0, rk3=20.0, nstep1=50000, nstep2=290000, iresid=1, &end
     
# 20-12
#  planarity restraint:  N9 N7 N1 N3
 &rst iat=20,20,12,12, atnam(1)='N9', atnam(2)='N7',
     atnam(3)='N1', atnam(4)='N3',
     r1=350.0, r2=355.0, r3=365.0, r4=370.0,
     rk2=20.0, rk3=20.0, nstep1=50000, nstep2=290000, iresid=1, &end

#  planarity restraint:  C5 C2 N7 C4
 &rst iat=20,20,12,12, atnam(1)='C5', atnam(2)='C2',
     atnam(3)='N7', atnam(4)='C4',
     r1=350.0, r2=355.0, r3=365.0, r4=370.0,
     rk2=20.0, rk3=20.0, nstep1=50000, nstep2=290000, iresid=1, &end

#  planarity restraint:  C2 C8 C2 C8
 &rst iat=20,20,12,12, atnam(1)='C2', atnam(2)='C8',
     atnam(3)='C2', atnam(4)='C8',
     r1=350.0, r2=355.0, r3=365.0, r4=370.0,
     rk2=20.0, rk3=20.0, nstep1=50000, nstep2=290000, iresid=1, &end

# 12-2
#  planarity restraints:  N9 N7 N1 N3
 &rst iat=12,12,2,2, atnam(1)='N9', atnam(2)='N7',
     atnam(3)='N1', atnam(4)='N3',
     r1=350.0, r2=355.0, r3=365.0, r4=370.0,
     rk2=20.0, rk3=20.0, nstep1=50000, nstep2=290000, iresid=1, &end

#  planarity restraint:  C5 C2 N7 C4
 &rst iat=12,12,2,2, atnam(1)='C5', atnam(2)='C2',
     atnam(3)='N7', atnam(4)='C4',
     r1=350.0, r2=355.0, r3=365.0, r4=370.0,
     rk2=20.0, rk3=20.0, nstep1=50000, nstep2=290000, iresid=1, &end

#  planarity restraint:  C2 C8 C2 C8
 &rst iat=12,12,2,2, atnam(1)='C2', atnam(2)='C8',
     atnam(3)='C2', atnam(4)='C8',
     r1=350.0, r2=355.0, r3=365.0, r4=370.0,
     rk2=20.0, rk3=20.0, nstep1=50000, nstep2=290000, iresid=1, &end
#
#
#
#  2nd QUARTET: 1-13-21-7
# 1-13
#  planarity restraint:  N9 N7 N1 N3
 &rst iat=1,1,13,13, atnam(1)='N9', atnam(2)='N7',
     atnam(3)='N1', atnam(4)='N3',
     r1=350.0, r2=355.0, r3=365.0, r4=370.0,
     rk2=20.0, rk3=20.0, nstep1=50000, nstep2=290000, iresid=1, &end

#  planarity restraint:  C5 C2 N7 C4
 &rst iat=1,1,13,13, atnam(1)='C5', atnam(2)='C2',
     atnam(3)='N7', atnam(4)='C4',
     r1=350.0, r2=355.0, r3=365.0, r4=370.0,
     rk2=20.0, rk3=20.0, nstep1=50000, nstep2=290000, iresid=1, &end

#  planarity restraint:  C2 C8 C2 C8
 &rst iat=1,1,13,13, atnam(1)='C2', atnam(2)='C8',
     atnam(3)='C2', atnam(4)='C8',
     r1=350.0, r2=355.0, r3=365.0, r4=370.0,
     rk2=20.0, rk3=20.0, nstep1=50000, nstep2=290000, iresid=1, &end
     
# 13-21     
#  planarity restraints:  N9 N7 N1 N3
 &rst iat=13,13,21,21, atnam(1)='N9', atnam(2)='N7',
     atnam(3)='N1', atnam(4)='N3',
     r1=350.0, r2=355.0, r3=365.0, r4=370.0,
     rk2=20.0, rk3=20.0, nstep1=50000, nstep2=290000, iresid=1, &end

#  planarity restraint:  C5 C2 N7 C4
 &rst iat=13,13,21,21, atnam(1)='C5', atnam(2)='C2',
     atnam(3)='N7', atnam(4)='C4',
     r1=350.0, r2=355.0, r3=365.0, r4=370.0,
     rk2=20.0, rk3=20.0, nstep1=50000, nstep2=290000, iresid=1, &end

#  planarity restraint:  C2 C8 C2 C8
 &rst iat=13,13,21,21, atnam(1)='C2', atnam(2)='C8',
     atnam(3)='C2', atnam(4)='C8',
     r1=350.0, r2=355.0, r3=365.0, r4=370.0,
     rk2=20.0, rk3=20.0, nstep1=50000, nstep2=290000, iresid=1, &end

# 21-7
#  planarity restraints:  N9 N7 N1 N3
 &rst iat=21,21,7,7, atnam(1)='N9', atnam(2)='N7',
     atnam(3)='N1', atnam(4)='N3',
     r1=350.0, r2=355.0, r3=365.0, r4=370.0,
     rk2=20.0, rk3=20.0, nstep1=50000, nstep2=290000, iresid=1, &end

#  planarity restraint:  C5 C2 N7 C4
 &rst iat=21,21,7,7, atnam(1)='C5', atnam(2)='C2',
     atnam(3)='N7', atnam(4)='C4',
     r1=350.0, r2=355.0, r3=365.0, r4=370.0,
     rk2=20.0, rk3=20.0, nstep1=50000, nstep2=290000, iresid=1, &end

#  planarity restraint:  C2 C8 C2 C8
 &rst iat=21,21,7,7, atnam(1)='C2', atnam(2)='C8',
     atnam(3)='C2', atnam(4)='C8',
     r1=350.0, r2=355.0, r3=365.0, r4=370.0,
     rk2=20.0, rk3=20.0, nstep1=50000, nstep2=290000, iresid=1, &end

# 7-1
#  planarity restraints:  N9 N7 N1 N3
 &rst iat=7,7,1,1, atnam(1)='N9', atnam(2)='N7',
     atnam(3)='N1', atnam(4)='N3',
     r1=350.0, r2=355.0, r3=365.0, r4=370.0,
     rk2=20.0, rk3=20.0, nstep1=50000, nstep2=290000, iresid=1, &end

#  planarity restraint:  C5 C2 N7 C4
 &rst iat=7,7,1,1, atnam(1)='C5', atnam(2)='C2',
     atnam(3)='N7', atnam(4)='C4',
     r1=350.0, r2=355.0, r3=365.0, r4=370.0,
     rk2=20.0, rk3=20.0, nstep1=50000, nstep2=290000, iresid=1, &end

#  planarity restraint:  C2 C8 C2 C8
 &rst iat=7,7,1,1, atnam(1)='C2', atnam(2)='C8',
     atnam(3)='C2', atnam(4)='C8',
     r1=350.0, r2=355.0, r3=365.0, r4=370.0,
     rk2=20.0, rk3=20.0, nstep1=50000, nstep2=290000, iresid=1, &end
#
#
#
#
# 3rd QUARTET: 11-14-22-8
# 11-14
#  planarity restraint:  N9 N7 N1 N3
 &rst iat=11,11,14,14, atnam(1)='N9', atnam(2)='N7',
     atnam(3)='N1', atnam(4)='N3',
     r1=350.0, r2=355.0, r3=365.0, r4=370.0,
     rk2=20.0, rk3=20.0, nstep1=50000, nstep2=290000, iresid=1, &end

#  planarity restraint:  C5 C2 N7 C4
 &rst iat=11,11,14,14, atnam(1)='C5', atnam(2)='C2',
     atnam(3)='N7', atnam(4)='C4',
     r1=350.0, r2=355.0, r3=365.0, r4=370.0,
     rk2=20.0, rk3=20.0, nstep1=50000, nstep2=290000, iresid=1, &end

#  planarity restraint:  C2 C8 C2 C8
 &rst iat=11,11,14,14, atnam(1)='C2', atnam(2)='C8',
     atnam(3)='C2', atnam(4)='C8',
     r1=350.0, r2=355.0, r3=365.0, r4=370.0,
     rk2=20.0, rk3=20.0, nstep1=50000, nstep2=290000, iresid=1, &end

# 14-22
#  planarity restraints:  N9 N7 N1 N3
 &rst iat=14,14,22,22, atnam(1)='N9', atnam(2)='N7',
     atnam(3)='N1', atnam(4)='N3',
     r1=350.0, r2=355.0, r3=365.0, r4=370.0,
     rk2=20.0, rk3=20.0, nstep1=50000, nstep2=290000, iresid=1, &end

#  planarity restraint:  C5 C2 N7 C4
 &rst iat=14,14,22,22, atnam(1)='C5', atnam(2)='C2',
     atnam(3)='N7', atnam(4)='C4',
     r1=350.0, r2=355.0, r3=365.0, r4=370.0,
     rk2=20.0, rk3=20.0, nstep1=50000, nstep2=290000, iresid=1, &end

#  planarity restraint:  C2 C8 C2 C8
 &rst iat=14,14,22,22, atnam(1)='C2', atnam(2)='C8',
     atnam(3)='C2', atnam(4)='C8',
     r1=350.0, r2=355.0, r3=365.0, r4=370.0,
     rk2=20.0, rk3=20.0, nstep1=50000, nstep2=290000, iresid=1, &end


# 22-8
#  planarity restraints:  N9 N7 N1 N3
 &rst iat=22,22,8,8, atnam(1)='N9', atnam(2)='N7',
     atnam(3)='N1', atnam(4)='N3',
     r1=350.0, r2=355.0, r3=365.0, r4=370.0,
     rk2=20.0, rk3=20.0, nstep1=50000, nstep2=290000, iresid=1, &end

#  planarity restraint:  C5 C2 N7 C4
 &rst iat=22,22,8,8, atnam(1)='C5', atnam(2)='C2',
     atnam(3)='N7', atnam(4)='C4',
     r1=350.0, r2=355.0, r3=365.0, r4=370.0,
     rk2=20.0, rk3=20.0, nstep1=50000, nstep2=290000, iresid=1, &end

#  planarity restraint:  C2 C8 C2 C8
 &rst iat=22,22,8,8, atnam(1)='C2', atnam(2)='C8',
     atnam(3)='C2', atnam(4)='C8',
     r1=350.0, r2=355.0, r3=365.0, r4=370.0,
     rk2=20.0, rk3=20.0, nstep1=50000, nstep2=290000, iresid=1, &end


# 8-11
#  planarity restraints:  N9 N7 N1 N3
 &rst iat=8,8,11,11, atnam(1)='N9', atnam(2)='N7',
     atnam(3)='N1', atnam(4)='N3',
     r1=350.0, r2=355.0, r3=365.0, r4=370.0,
     rk2=20.0, rk3=20.0, nstep1=50000, nstep2=290000, iresid=1, &end

#  planarity restraint:  C5 C2 N7 C4
 &rst iat=8,8,11,11, atnam(1)='C5', atnam(2)='C2',
     atnam(3)='N7', atnam(4)='C4',
     r1=350.0, r2=355.0, r3=365.0, r4=370.0,
     rk2=20.0, rk3=20.0, nstep1=50000, nstep2=290000, iresid=1, &end

#  planarity restraint:  C2 C8 C2 C8
 &rst iat=8,8,11,11, atnam(1)='C2', atnam(2)='C8',
     atnam(3)='C2', atnam(4)='C8',
     r1=350.0, r2=355.0, r3=365.0, r4=370.0,
     rk2=20.0, rk3=20.0, nstep1=50000, nstep2=290000, iresid=1, &end

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