NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
631453 | 6gzn | 34297 | cing | 1-original | 2 | AMBER | planarity |
# Restraints file 3: RANG4T_PLANARITY.list # 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=0, nstep2=225000, 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, iresid=1, &end # # planarity restraint: C8 C2 C8 C2 &rst iat=1,1,13,13, atnam(1)='C8', atnam(2)='C2', atnam(3)='C8', atnam(4)='C2', r1=350.0, r2=355.0, r3=365.0, r4=370.0, iresid=1, &end # # 13-19 planarity restraints: N9 N7 N1 N3 &rst iat=13,13,19,19, atnam(1)='N9', atnam(2)='N7', atnam(3)='N1', atnam(4)='N3', r1=350.0, r2=355.0, r3=365.0, r4=370.0, iresid=1, &end # # planarity restraint: C5 C2 N7 C4 &rst iat=13,13,19,19, atnam(1)='C5', atnam(2)='C2', atnam(3)='N7', atnam(4)='C4', r1=350.0, r2=355.0, r3=365.0, r4=370.0, iresid=1, &end # # planarity restraint: C8 C2 C8 C2 &rst iat=13,13,19,19, atnam(1)='C8', atnam(2)='C2', atnam(3)='C8', atnam(4)='C2', r1=350.0, r2=355.0, r3=365.0, r4=370.0, iresid=1, &end # # 19-7 # planarity restraint: N9 N7 N1 N3 &rst iat=19,19,7,7, atnam(1)='N9', atnam(2)='N7', atnam(3)='N1', atnam(4)='N3', r1=350.0, r2=355.0, r3=365.0, r4=370.0, iresid=1, &end # # planarity restraint: C5 C2 N7 C4 &rst iat=19,19,7,7, atnam(1)='C5', atnam(2)='C2', atnam(3)='N7', atnam(4)='C4', r1=350.0, r2=355.0, r3=365.0, r4=370.0, iresid=1, &end # planarity restraint: C8 C2 C8 C2 &rst iat=19,19,7,7, atnam(1)='C8', atnam(2)='C2', atnam(3)='C8', atnam(4)='C2', r1=350.0, r2=355.0, r3=365.0, r4=370.0, 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, 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, iresid=1, &end # # planarity restraint: C8 C2 C8 C2 &rst iat=7,7,1,1, atnam(1)='C8', atnam(2)='C2', atnam(3)='C8', atnam(4)='C2', r1=350.0, r2=355.0, r3=365.0, r4=370.0, iresid=1, &end # # 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, 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, iresid=1, &end # # planarity restraint: C8 C2 C8 C2 &rst iat=2,2,6,6, atnam(1)='C8', atnam(2)='C2', atnam(3)='C8', atnam(4)='C2', r1=350.0, r2=355.0, r3=365.0, r4=370.0, iresid=1, &end # # 6-18 # planarity restraints: N9 N7 N1 N3 &rst iat=6,6,18,18, atnam(1)='N9', atnam(2)='N7', atnam(3)='N1', atnam(4)='N3', r1=350.0, r2=355.0, r3=365.0, r4=370.0, iresid=1, &end # # planarity restraint: C5 C2 N7 C4 &rst iat=6,6,18,18, atnam(1)='C5', atnam(2)='C2', atnam(3)='N7', atnam(4)='C4', r1=350.0, r2=355.0, r3=365.0, r4=370.0, iresid=1, &end # # planarity restraint: C8 C2 C8 C2 &rst iat=6,6,18,18, atnam(1)='C8', atnam(2)='C2', atnam(3)='C8', atnam(4)='C2', r1=350.0, r2=355.0, r3=365.0, r4=370.0, iresid=1, &end # # 18-14 # planarity restraints: N9 N7 N1 N3 &rst iat=18,18,14,14, atnam(1)='N9', atnam(2)='N7', atnam(3)='N1', atnam(4)='N3', r1=350.0, r2=355.0, r3=365.0, r4=370.0, iresid=1, &end # planarity restraint: C5 C2 N7 C4 &rst iat=18,18,14,14, atnam(1)='C5', atnam(2)='C2', atnam(3)='N7', atnam(4)='C4', r1=350.0, r2=355.0, r3=365.0, r4=370.0, iresid=1, &end # planarity restraint: C8 C2 C8 C2 &rst iat=18,18,14,14, atnam(1)='C8', atnam(2)='C2', atnam(3)='C8', atnam(4)='C2', r1=350.0, r2=355.0, r3=365.0, r4=370.0, iresid=1, &end # 14-2 # planarity restraints: N9 N7 N1 N3 &rst iat=14,14,2,2, atnam(1)='N9', atnam(2)='N7', atnam(3)='N1', atnam(4)='N3', r1=350.0, r2=355.0, r3=365.0, r4=370.0, iresid=1, &end # # planarity restraint: C5 C2 N7 C4 &rst iat=14,14,2,2, atnam(1)='C5', atnam(2)='C2', atnam(3)='N7', atnam(4)='C4', r1=350.0, r2=355.0, r3=365.0, r4=370.0, iresid=1, &end # # planarity restraint: C8 C2 C8 C2 &rst iat=14,14,2,2, atnam(1)='C8', atnam(2)='C2', atnam(3)='C8', atnam(4)='C2', r1=350.0, r2=355.0, r3=365.0, r4=370.0, iresid=1, &end # # 8-20 # planarity restraint: N9 N7 N1 N3 &rst iat=20,20,8,8, 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=225000, iresid=1, &end # # planarity restraint: C5 C2 N7 C4 &rst iat=20,20,8,8, atnam(1)='C5', atnam(2)='C2', atnam(3)='N7', atnam(4)='C4', r1=350.0, r2=355.0, r3=365.0, r4=370.0, iresid=1, &end # # planarity restraint: C8 C2 C8 C2 &rst iat=20,20,8,8, atnam(1)='C8', atnam(2)='C2', atnam(3)='C8', atnam(4)='C2', r1=350.0, r2=355.0, r3=365.0, r4=370.0, iresid=1, &end # # 8-12 # planarity restraints: N9 N7 C6 N3 &rst iat=12,12,8,8, atnam(1)='N9', atnam(2)='N7', atnam(3)='C6', atnam(4)='N3', r1=170.0, r2=175.0, r3=185.0, r4=190.0, iresid=1, &end # # planarity restraint: C4 C2 C4 N7 &rst iat=12,12,8,8, atnam(1)='C4', atnam(2)='C2', atnam(3)='C4', atnam(4)='N7', r1=350.0, r2=355.0, r3=365.0, r4=370.0, iresid=1, &end # # planarity restraint: C8 C2 C2 C8 &rst iat=12,12,8,8, atnam(1)='C8', atnam(2)='C2', atnam(3)='C2', atnam(4)='C8', r1=350.0, r2=355.0, r3=365.0, r4=370.0, iresid=1, &end # # 3-17 # planarity restraint: N9 N7 C5 N3 &rst iat=3,3,17,17, atnam(1)='N9', atnam(2)='N7', atnam(3)='C5', atnam(4)='N3', r1=350.0, r2=355.0, r3=365.0, r4=370.0, iresid=1, &end # # planarity restraint: C5 C2 C4 N7 &rst iat=3,3,17,17, atnam(1)='C5', atnam(2)='C2', atnam(3)='C4', atnam(4)='N7', r1=350.0, r2=355.0, r3=365.0, r4=370.0, iresid=1, &end # # planarity restraint: C8 C2 C2 C8 &rst iat=3,3,17,17, atnam(1)='C8', atnam(2)='C2', atnam(3)='C2', atnam(4)='C8', r1=350.0, r2=355.0, r3=365.0, r4=370.0, iresid=1, &end # # 3-5 # planarity restraints: N7 N9 N1 N3 &rst iat=3,3,5,5, atnam(1)='N7', atnam(2)='N9', atnam(3)='N1', atnam(4)='N3', r1=350.0, r2=355.0, r3=365.0, r4=370.0, iresid=1, &end # # planarity restraint: C5 C2 N7 C4 &rst iat=3,3,5,5, atnam(1)='C5', atnam(2)='C2', atnam(3)='N7', atnam(4)='C4', r1=350.0, r2=355.0, r3=365.0, r4=370.0, iresid=1, &end # # planarity restraint: C8 C2 C8 C2 &rst iat=3,3,5,5, atnam(1)='C8', atnam(2)='C2', atnam(3)='C8', atnam(4)='C2', r1=350.0, r2=355.0, r3=365.0, r4=370.0, iresid=1, &end #
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