Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
|
|
594993 | 2n2d RC | 25596 | cing | 1-original | 4 | AMBER | planarity |
# PLANARITY RESTRAINTS
#
# FIRST QUARTET: 1-10-13-22
#
# 1-10
# planaritets restraint: N9 N7 N1 N3
&rst iat=1,1,10,10, 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=0, nstep2=100000, iresid=1, &end
# planaritets restraint: C5 C2 N7 C4
&rst iat=1,1,10,10, 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=0, nstep2=100000, iresid=1, &end
# planaritets restraint: C2 C8 C2 C8
&rst iat=1,1,10,10, 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=0, nstep2=100000, iresid=1, &end
# 10-13
# planarity restraints: N9 N7 N1 N3
&rst iat=10,10,13,13, 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=0, nstep2=100000, iresid=1, &end
# planaritets restraint: C5 C2 N7 C4
&rst iat=10,10,13,13, 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=0, nstep2=100000, iresid=1, &end
# planaritets restraint: C2 C8 C2 C8
&rst iat=10,10,13,13, 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=0, nstep2=100000, iresid=1, &end
# 13-22
# planaritets restraint: N9 N7 N1 N3
&rst iat=13,13,22,22, 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=0, nstep2=100000, iresid=1, &end
# planaritets restraint: C5 C2 N7 C4
&rst iat=13,13,22,22, 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=0, nstep2=100000, iresid=1, &end
# planaritets restraint: C2 C8 C2 C8
&rst iat=13,13,22,22, 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=0, nstep2=100000, iresid=1, &end
# 22-1
# planarity restraints: N9 N7 N1 N3
&rst iat=22,22,1,1, 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=0, nstep2=100000, iresid=1, &end
# planaritets restraint: C5 C2 N7 C4
&rst iat=22,22,1,1, 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=0, nstep2=100000, iresid=1, &end
# planaritets restraint: C2 C8 C2 C8
&rst iat=22,22,1,1, 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=0, nstep2=100000, iresid=1, &end
# SECOND QUARTET: 2-21-14-9
# 2-21
# planaritets restraint: N9 N7 N1 N3
&rst iat=2,2,21,21, 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=0, nstep2=100000, iresid=1, &end
# planaritets restraint: C5 C2 N7 C4
&rst iat=2,2,21,21, 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=0, nstep2=100000, iresid=1, &end
# planaritets restraint: C2 C8 C2 C8
&rst iat=2,2,21,21, 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=0, nstep2=100000, iresid=1, &end
# 21-14
# planarity restraints: N9 N7 N1 N3
&rst iat=21,21,14,14, 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=0, nstep2=100000, iresid=1, &end
# planaritets restraint: C5 C2 N7 C4
&rst iat=21,21,14,14, 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=0, nstep2=100000, iresid=1, &end
# planaritets restraint: C2 C8 C2 C8
&rst iat=21,21,14,14, 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=0, nstep2=100000, iresid=1, &end
# 14-9
# planarity restraints: N9 N7 N1 N3
&rst iat=14,14,9,9, 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=0, nstep2=100000, iresid=1, &end
# planaritets restraint: C5 C2 N7 C4
&rst iat=14,14,9,9, 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=0, nstep2=100000, iresid=1, &end
# planaritets restraint: C2 C8 C2 C8
&rst iat=14,14,9,9, 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=0, nstep2=100000, iresid=1, &end
# 9-2
# planarity restraints: N9 N7 N1 N3
&rst iat=9,9,2,2, 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=0, nstep2=100000, iresid=1, &end
# planaritets restraint: C5 C2 N7 C4
&rst iat=9,9,2,2, 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=0, nstep2=100000, iresid=1, &end
# planaritets restraint: C2 C8 C2 C8
&rst iat=9,9,2,2, 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=0, nstep2=100000, iresid=1, &end
#
#THIRD QUARTET: 3-8-15-20
# 3-8
# planaritets restraint: N9 N7 N1 N3
&rst iat=3,3,8,8, 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=0, nstep2=100000, iresid=1, &end
# planaritets restraint: C5 C2 N7 C4
&rst iat=3,3,8,8, 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=0, nstep2=100000, iresid=1, &end
# planaritets restraint: C2 C8 C2 C8
&rst iat=3,3,8,8, 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=0, nstep2=100000, iresid=1, &end
# 8-15
# planarity restraints: N9 N7 N1 N3
&rst iat=8,8,15,15, 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=0, nstep2=100000, iresid=1, &end
# planaritets restraint: C5 C2 N7 C4
&rst iat=8,8,15,15, 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=0, nstep2=100000, iresid=1, &end
# planaritets restraint: C2 C8 C2 C8
&rst iat=8,8,15,15, 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=0, nstep2=100000, iresid=1, &end
# 15-20
# planarity restraints: N9 N7 N1 N3
&rst iat=15,15,20,20, 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=0, nstep2=100000, iresid=1, &end
# planaritets restraint: C5 C2 N7 C4
&rst iat=15,15,20,20, 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=0, nstep2=100000, iresid=1, &end
# planaritets restraint: C2 C8 C2 C8
&rst iat=15,15,20,20, 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=0, nstep2=100000, iresid=1, &end
# 20-3
# planarity restraints: N9 N7 N1 N3
&rst iat=20,20,3,3, 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=0, nstep2=100000, iresid=1, &end
# planaritets restraint: C5 C2 N7 C4
&rst iat=20,20,3,3, 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=0, nstep2=100000, iresid=1, &end
# planaritets restraint: C2 C8 C2 C8
&rst iat=20,20,3,3, 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=0, nstep2=100000, iresid=1, &end
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#FOURTH QUARTET: 4-19-16-7
# 4-19
# planarity restraints: N9 N7 N1 N3
&rst iat=4,4,19,19, 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=20.0, rk3=20.0, nstep1=0, nstep2=100000, iresid=1, &end
# planaritets restraint: C5 C2 N7 C4
&rst iat=4,4,19,19, 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=20.0, rk3=20.0, nstep1=0, nstep2=100000, iresid=1, &end
# planaritets restraint: C2 C8 C2 C8
&rst iat=4,4,19,19, 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=20.0, rk3=20.0, nstep1=0, nstep2=100000, iresid=1, &end
# 19-16
# planarity restraints: N9 N7 N1 N3
&rst iat=19,19,16,16, 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=0, nstep2=100000, iresid=1, &end
# planaritets restraint: C5 C2 N7 C4
&rst iat=19,19,16,16, 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=0, nstep2=100000, iresid=1, &end
# planaritets restraint: C2 C8 C2 C8
&rst iat=19,19,16,16, 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=0, nstep2=100000, iresid=1, &end
# 16-7
# planarity restraints: N9 N7 N1 N3
&rst iat=16,16,7,7, 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=0, nstep2=100000, iresid=1, &end
# planaritets restraint: C5 C2 N7 C4
&rst iat=16,16,7,7, 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=0, nstep2=100000, iresid=1, &end
# planaritets restraint: C2 C8 C2 C8
&rst iat=16,16,7,7, 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=0, nstep2=100000, iresid=1, &end
# 7-4
# planarity restraints: N9 N7 N1 N3
&rst iat=7,7,4,4, 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=0, nstep2=100000, iresid=1, &end
# planaritets restraint: C5 C2 N7 C4
&rst iat=7,7,4,4, 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=0, nstep2=100000, iresid=1, &end
# planaritets restraint: C2 C8 C2 C8
&rst iat=7,7,4,4, 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=0, nstep2=100000, iresid=1, &end
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