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

652361 6zl9 34525 cing 1-original 5 AMBER planarity
# PLANARITY RESTRAINTS# QUARTET: 18-22-27-31
# 18-22
#  planarity restraint:  N9 N7 N1 N3
 &rst iat=18,18,22,22, 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=30.0, rk3=30.0, nstep1=0,  nstep2=0, iresid=1, &end

#  planarity restraint:  C5 C2 N7 C4
 &rst iat=18,18,22,22, 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=30.0, rk3=30.0, nstep1=0,  nstep2=0, iresid=1, &end

#  planarity restraint:  C2 C8 C2 C8
 &rst iat=18,18,22,22, 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=30.0, rk3=30.0, nstep1=0,  nstep2=0, iresid=1, &end

# 22-27
#  planarity restraint:  N9 N7 N1 N3
 &rst iat=22,22,27,27, 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=30.0, rk3=30.0, nstep1=0,  nstep2=0, iresid=1, &end

#  planarity restraint:  C5 C2 N7 C4
 &rst iat=22,22,27,27, 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=30.0, rk3=30.0, nstep1=0,  nstep2=0, iresid=1, &end

#  planarity restraint:  C2 C8 C2 C8
 &rst iat=22,22,27,27, 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=30.0, rk3=30.0, nstep1=0,  nstep2=0, iresid=1, &end

# 27-31
#  planarity restraint:  N9 N7 N1 N3
 &rst iat=27,27,31,31, 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=30.0, rk3=30.0, nstep1=0,  nstep2=0, iresid=1, &end

#  planarity restraint:  C5 C2 N7 C4
 &rst iat=27,27,31,31, 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=30.0, rk3=30.0, nstep1=0,  nstep2=0, iresid=1, &end

#  planarity restraint:  C2 C8 C2 C8
 &rst iat=27,27,31,31, 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=30.0, rk3=30.0, nstep1=0,  nstep2=0, iresid=1, &end

# 31-18
#  planarity restraint:  N9 N7 N1 N3
 &rst iat=31,31,18,18, 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=30.0, rk3=30.0, nstep1=0,  nstep2=0, iresid=1, &end

#  planarity restraint:  C5 C2 N7 C4
 &rst iat=31,31,18,18, 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=30.0, rk3=30.0, nstep1=0,  nstep2=0, iresid=1, &end

#  planarity restraint:  C2 C8 C2 C8
 &rst iat=31,31,18,18, 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=30.0, rk3=30.0, nstep1=0,  nstep2=0, iresid=1, &end

# QUARTET: 19-23-28-32
# 19-23
#  planarity restraint:  N9 N7 N1 N3
 &rst iat=19,19,23,23, 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=30.0, rk3=30.0, nstep1=0,  nstep2=0, iresid=1, &end

#  planarity restraint:  C5 C2 N7 C4
 &rst iat=19,19,23,23, 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=30.0, rk3=30.0, nstep1=0,  nstep2=0, iresid=1, &end

#  planarity restraint:  C2 C8 C2 C8
 &rst iat=19,19,23,23, 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=30.0, rk3=30.0, nstep1=0,  nstep2=0, iresid=1, &end

# 23-28
#  planarity restraint:  N9 N7 N1 N3
 &rst iat=23,23,28,28, 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=30.0, rk3=30.0, nstep1=0,  nstep2=0, iresid=1, &end

#  planarity restraint:  C5 C2 N7 C4
 &rst iat=23,23,28,28, 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=30.0, rk3=30.0, nstep1=0,  nstep2=0, iresid=1, &end

#  planarity restraint:  C2 C8 C2 C8
 &rst iat=23,23,28,28, 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=30.0, rk3=30.0, nstep1=0,  nstep2=0, iresid=1, &end

# 28-32
#  planarity restraint:  N9 N7 N1 N3
 &rst iat=28,28,32,32, 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=30.0, rk3=30.0, nstep1=0,  nstep2=0, iresid=1, &end

#  planarity restraint:  C5 C2 N7 C4
 &rst iat=28,28,32,32, 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=30.0, rk3=30.0, nstep1=0,  nstep2=0, iresid=1, &end

#  planarity restraint:  C2 C8 C2 C8
 &rst iat=28,28,32,32, 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=30.0, rk3=30.0, nstep1=0,  nstep2=0, iresid=1, &end

# 32-19
#  planarity restraint:  N9 N7 N1 N3
 &rst iat=32,32,19,19, 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=30.0, rk3=30.0, nstep1=0,  nstep2=0, iresid=1, &end

#  planarity restraint:  C5 C2 N7 C4
 &rst iat=32,32,19,19, 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=30.0, rk3=30.0, nstep1=0,  nstep2=0, iresid=1, &end

#  planarity restraint:  C2 C8 C2 C8
 &rst iat=32,32,19,19, 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=30.0, rk3=30.0, nstep1=0,  nstep2=0, iresid=1, &end

# QUARTET: 20-24-29-33
# 20-24
#  planarity restraint:  N9 N7 N1 N3
 &rst iat=20,20,24,24, 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=30.0, rk3=30.0, nstep1=0,  nstep2=0, iresid=1, &end

#  planarity restraint:  C5 C2 N7 C4
 &rst iat=20,20,24,24, 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=30.0, rk3=30.0, nstep1=0,  nstep2=0, iresid=1, &end

#  planarity restraint:  C2 C8 C2 C8
 &rst iat=20,20,24,24, 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=30.0, rk3=30.0, nstep1=0,  nstep2=0, iresid=1, &end

# 24-29
#  planarity restraint:  N9 N7 N1 N3
 &rst iat=24,24,29,29, 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=30.0, rk3=30.0, nstep1=0,  nstep2=0, iresid=1, &end

#  planarity restraint:  C5 C2 N7 C4
 &rst iat=24,24,29,29, 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=30.0, rk3=30.0, nstep1=0,  nstep2=0, iresid=1, &end

#  planarity restraint:  C2 C8 C2 C8
 &rst iat=24,24,29,29, 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=30.0, rk3=30.0, nstep1=0,  nstep2=0, iresid=1, &end

# 29-33
#  planarity restraint:  N9 N7 N1 N3
 &rst iat=29,29,33,33, 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=30.0, rk3=30.0, nstep1=0,  nstep2=0, iresid=1, &end

#  planarity restraint:  C5 C2 N7 C4
 &rst iat=29,29,33,33, 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=30.0, rk3=30.0, nstep1=0,  nstep2=0, iresid=1, &end

#  planarity restraint:  C2 C8 C2 C8
 &rst iat=29,29,33,33, 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=30.0, rk3=30.0, nstep1=0,  nstep2=0, iresid=1, &end

# 33-20
#  planarity restraint:  N9 N7 N1 N3
 &rst iat=33,33,20,20, 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=30.0, rk3=30.0, nstep1=0,  nstep2=0, iresid=1, &end

#  planarity restraint:  C5 C2 N7 C4
 &rst iat=33,33,20,20, 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=30.0, rk3=30.0, nstep1=0,  nstep2=0, iresid=1, &end

#  planarity restraint:  C2 C8 C2 C8
 &rst iat=33,33,20,20, 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=30.0, rk3=30.0, nstep1=0,  nstep2=0, iresid=1, &end
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Contact the webmaster for help, if required. Monday, April 29, 2024 4:40:49 PM GMT (wattos1)
image	mrblock_id	pdb_id	bmrb_id	cing	stage	position	program	type
	652361	6zl9	34525	cing	1-original	5	AMBER	planarity