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 subtype
561999 2m1g 18862 cing 1-original 2 AMBER stereochemistry chirality


###
# gamma1 (en B~30, en A~-50) res 3  (3 em amber7)
 &rst iresid=1, iat(1)=3,iat(2)=3,iat(3)=3,iat(4)=3, 
  atnam(1)='O4''', atnam(2)='C1''', atnam(3)='C2''', atnam(4)='C3''',
  r1= -25.0, r2= 0.0, r3= 65.0, r4= 115.0, 
  rk2 =19.100, rk3 =19.100, &end
# gamma2 (en B~-30, en A~+45)res 3
 &rst iresid=1, iat(1)=3,iat(2)=3,iat(3)=3,iat(4)=3, 
  atnam(1)='C1''', atnam(2)='C2''', atnam(3)='C3''', atnam(4)='C4''',
  r1= -115.0, r2= -65.0, r3= 5.0, r4= 30.0,
  rk2 =19.100, rk3 =19.100, &end
# DELTA (en B~+135, en A~+80)res 3
 &rst iresid=1, iat(1)=3,iat(2)=3,iat(3)=3,iat(4)=3, 
  atnam(1)='C5''', atnam(2)='C4''', atnam(3)='C3''', atnam(4)='O3''',
  r1=  75.0, r2=100.0, r3= 170.0, r4= 220.0, 
  rk2 =19.100, rk3 =19.100, &end
###
# gamma1 (en B~30, en A~-50) res 4  (4 em amber7)
 &rst iresid=1, iat(1)=4,iat(2)=4,iat(3)=4,iat(4)=4, 
  atnam(1)='O4''', atnam(2)='C1''', atnam(3)='C2''', atnam(4)='C3''',
  r1= -25.0, r2= 0.0, r3= 65.0, r4= 115.0, 
  rk2 =19.100, rk3 =19.100, &end
# gamma2 (en B~-30, en A~+45)res 4
 &rst iresid=1, iat(1)=4,iat(2)=4,iat(3)=4,iat(4)=4, 
  atnam(1)='C1''', atnam(2)='C2''', atnam(3)='C3''', atnam(4)='C4''',
  r1= -115.0, r2= -65.0, r3= 5.0, r4= 30.0,
  rk2 =19.100, rk3 =19.100, &end
# DELTA (en B~+135, en A~+80)res 4
 &rst iresid=1, iat(1)=4,iat(2)=4,iat(3)=4,iat(4)=4, 
  atnam(1)='C5''', atnam(2)='C4''', atnam(3)='C3''', atnam(4)='O3''',
  r1=  75.0, r2=100.0, r3= 170.0, r4= 220.0, 
  rk2 =19.100, rk3 =19.100, &end
###
# gamma1 (en B~30, en A~-50) res 5  (5 em amber7)
 &rst iresid=1, iat(1)=5,iat(2)=5,iat(3)=5,iat(4)=5, 
  atnam(1)='O4''', atnam(2)='C1''', atnam(3)='C2''', atnam(4)='C3''',
  r1= -25.0, r2= 0.0, r3= 65.0, r4= 115.0, 
  rk2 =19.100, rk3 =19.100, &end
# gamma2 (en B~-30, en A~+45)res 5
 &rst iresid=1, iat(1)=5,iat(2)=5,iat(3)=5,iat(4)=5, 
  atnam(1)='C1''', atnam(2)='C2''', atnam(3)='C3''', atnam(4)='C4''',
  r1= -115.0, r2= -65.0, r3= 5.0, r4= 30.0,
  rk2 =19.100, rk3 =19.100, &end
# DELTA (en B~+135, en A~+80)res 5
 &rst iresid=1, iat(1)=5,iat(2)=5,iat(3)=5,iat(4)=5, 
  atnam(1)='C5''', atnam(2)='C4''', atnam(3)='C3''', atnam(4)='O3''',
  r1=  75.0, r2=100.0, r3= 170.0, r4= 220.0, 
  rk2 =19.100, rk3 =19.100, &end
###
# gamma1 (en B~30, en A~-50) res 9  (9 em amber7)
 &rst iresid=1, iat(1)=9,iat(2)=9,iat(3)=9,iat(4)=9, 
  atnam(1)='O4''', atnam(2)='C1''', atnam(3)='C2''', atnam(4)='C3''',
  r1= -25.0, r2= 0.0, r3= 65.0, r4= 115.0, 
  rk2 =19.100, rk3 =19.100, &end
# gamma2 (en B~-30, en A~+45)res 9
 &rst iresid=1, iat(1)=9,iat(2)=9,iat(3)=9,iat(4)=9, 
  atnam(1)='C1''', atnam(2)='C2''', atnam(3)='C3''', atnam(4)='C4''',
  r1= -115.0, r2= -65.0, r3= 5.0, r4= 30.0,
  rk2 =19.100, rk3 =19.100, &end
# DELTA (en B~+135, en A~+80)res 9
 &rst iresid=1, iat(1)=9,iat(2)=9,iat(3)=9,iat(4)=9, 
  atnam(1)='C5''', atnam(2)='C4''', atnam(3)='C3''', atnam(4)='O3''',
  r1=  75.0, r2=100.0, r3= 170.0, r4= 220.0, 
  rk2 =19.100, rk3 =19.100, &end
###
# gamma1 (en B~30, en A~-50) res 10  (10 em amber7)
 &rst iresid=1, iat(1)=10,iat(2)=10,iat(3)=10,iat(4)=10, 
  atnam(1)='O4''', atnam(2)='C1''', atnam(3)='C2''', atnam(4)='C3''',
  r1= -25.0, r2= 0.0, r3= 65.0, r4= 115.0, 
  rk2 =19.100, rk3 =19.100, &end
# gamma2 (en B~-30, en A~+45)res 10
 &rst iresid=1, iat(1)=10,iat(2)=10,iat(3)=10,iat(4)=10, 
  atnam(1)='C1''', atnam(2)='C2''', atnam(3)='C3''', atnam(4)='C4''',
  r1= -115.0, r2= -65.0, r3= 5.0, r4= 30.0,
  rk2 =19.100, rk3 =19.100, &end
# DELTA (en B~+135, en A~+80)res 10
 &rst iresid=1, iat(1)=10,iat(2)=10,iat(3)=10,iat(4)=10, 
  atnam(1)='C5''', atnam(2)='C4''', atnam(3)='C3''', atnam(4)='O3''',
  r1=  75.0, r2=100.0, r3= 170.0, r4= 220.0, 
  rk2 =19.100, rk3 =19.100, &end
###
# gamma1 (en B~30, en A~-50) res 11  (11 em amber7)
 &rst iresid=1, iat(1)=11,iat(2)=11,iat(3)=11,iat(4)=11, 
  atnam(1)='O4''', atnam(2)='C1''', atnam(3)='C2''', atnam(4)='C3''',
  r1= -25.0, r2= 0.0, r3= 65.0, r4= 115.0, 
  rk2 =19.100, rk3 =19.100, &end
# gamma2 (en B~-30, en A~+45)res 11
 &rst iresid=1, iat(1)=11,iat(2)=11,iat(3)=11,iat(4)=11, 
  atnam(1)='C1''', atnam(2)='C2''', atnam(3)='C3''', atnam(4)='C4''',
  r1= -115.0, r2= -65.0, r3= 5.0, r4= 30.0,
  rk2 =19.100, rk3 =19.100, &end
# DELTA (en B~+135, en A~+80)res 11
 &rst iresid=1, iat(1)=11,iat(2)=11,iat(3)=11,iat(4)=11, 
  atnam(1)='C5''', atnam(2)='C4''', atnam(3)='C3''', atnam(4)='O3''',
  r1=  75.0, r2=100.0, r3= 170.0, r4= 220.0, 
  rk2 =19.100, rk3 =19.100, &end
###
# gamma1 (en B~30, en A~-50) res 15  (15 em amber7)
 &rst iresid=1, iat(1)=15,iat(2)=15,iat(3)=15,iat(4)=15, 
  atnam(1)='O4''', atnam(2)='C1''', atnam(3)='C2''', atnam(4)='C3''',
  r1= -25.0, r2= 0.0, r3= 65.0, r4= 115.0, 
  rk2 =19.100, rk3 =19.100, &end
# gamma2 (en B~-30, en A~+45)res 15
 &rst iresid=1, iat(1)=15,iat(2)=15,iat(3)=15,iat(4)=15, 
  atnam(1)='C1''', atnam(2)='C2''', atnam(3)='C3''', atnam(4)='C4''',
  r1= -115.0, r2= -65.0, r3= 5.0, r4= 30.0,
  rk2 =19.100, rk3 =19.100, &end
# DELTA (en B~+135, en A~+80)res 15
 &rst iresid=1, iat(1)=15,iat(2)=15,iat(3)=15,iat(4)=15, 
  atnam(1)='C5''', atnam(2)='C4''', atnam(3)='C3''', atnam(4)='O3''',
  r1=  75.0, r2=100.0, r3= 170.0, r4= 220.0, 
  rk2 =19.100, rk3 =19.100, &end
###
# gamma1 (en B~30, en A~-50) res 16  (16 em amber7)
 &rst iresid=1, iat(1)=16,iat(2)=16,iat(3)=16,iat(4)=16, 
  atnam(1)='O4''', atnam(2)='C1''', atnam(3)='C2''', atnam(4)='C3''',
  r1= -25.0, r2= 0.0, r3= 65.0, r4= 115.0, 
  rk2 =19.100, rk3 =19.100, &end
# gamma2 (en B~-30, en A~+45)res 16
 &rst iresid=1, iat(1)=16,iat(2)=16,iat(3)=16,iat(4)=16, 
  atnam(1)='C1''', atnam(2)='C2''', atnam(3)='C3''', atnam(4)='C4''',
  r1= -115.0, r2= -65.0, r3= 5.0, r4= 30.0,
  rk2 =19.100, rk3 =19.100, &end
# DELTA (en B~+135, en A~+80)res 16
 &rst iresid=1, iat(1)=16,iat(2)=16,iat(3)=16,iat(4)=16, 
  atnam(1)='C5''', atnam(2)='C4''', atnam(3)='C3''', atnam(4)='O3''',
  r1=  75.0, r2=100.0, r3= 170.0, r4= 220.0, 
  rk2 =19.100, rk3 =19.100, &end
###
# gamma1 (en B~30, en A~-50) res 17  (17 em amber7)
 &rst iresid=1, iat(1)=17,iat(2)=17,iat(3)=17,iat(4)=17, 
  atnam(1)='O4''', atnam(2)='C1''', atnam(3)='C2''', atnam(4)='C3''',
  r1= -25.0, r2= 0.0, r3= 65.0, r4= 115.0, 
  rk2 =19.100, rk3 =19.100, &end
# gamma2 (en B~-30, en A~+45)res 17
 &rst iresid=1, iat(1)=17,iat(2)=17,iat(3)=17,iat(4)=17, 
  atnam(1)='C1''', atnam(2)='C2''', atnam(3)='C3''', atnam(4)='C4''',
  r1= -115.0, r2= -65.0, r3= 5.0, r4= 30.0,
  rk2 =19.100, rk3 =19.100, &end
# DELTA (en B~+135, en A~+80)res 17
 &rst iresid=1, iat(1)=17,iat(2)=17,iat(3)=17,iat(4)=17, 
  atnam(1)='C5''', atnam(2)='C4''', atnam(3)='C3''', atnam(4)='O3''',
  r1=  75.0, r2=100.0, r3= 170.0, r4= 220.0, 
  rk2 =19.100, rk3 =19.100, &end
###
# gamma1 (en B~30, en A~-50) res 21  (21 em amber7)
 &rst iresid=1, iat(1)=21,iat(2)=21,iat(3)=21,iat(4)=21, 
  atnam(1)='O4''', atnam(2)='C1''', atnam(3)='C2''', atnam(4)='C3''',
  r1= -25.0, r2= 0.0, r3= 65.0, r4= 115.0, 
  rk2 =19.100, rk3 =19.100, &end
# gamma2 (en B~-30, en A~+45)res 21
 &rst iresid=1, iat(1)=21,iat(2)=21,iat(3)=21,iat(4)=21, 
  atnam(1)='C1''', atnam(2)='C2''', atnam(3)='C3''', atnam(4)='C4''',
  r1= -115.0, r2= -65.0, r3= 5.0, r4= 30.0,
  rk2 =19.100, rk3 =19.100, &end
# DELTA (en B~+135, en A~+80)res 21
 &rst iresid=1, iat(1)=21,iat(2)=21,iat(3)=21,iat(4)=21, 
  atnam(1)='C5''', atnam(2)='C4''', atnam(3)='C3''', atnam(4)='O3''',
  r1=  75.0, r2=100.0, r3= 170.0, r4= 220.0, 
  rk2 =19.100, rk3 =19.100, &end
###
# gamma1 (en B~30, en A~-50) res 22  (22 em amber7)
 &rst iresid=1, iat(1)=22,iat(2)=22,iat(3)=22,iat(4)=22, 
  atnam(1)='O4''', atnam(2)='C1''', atnam(3)='C2''', atnam(4)='C3''',
  r1= -25.0, r2= 0.0, r3= 65.0, r4= 115.0, 
  rk2 =19.100, rk3 =19.100, &end
# gamma2 (en B~-30, en A~+45)res 22
 &rst iresid=1, iat(1)=22,iat(2)=22,iat(3)=22,iat(4)=22, 
  atnam(1)='C1''', atnam(2)='C2''', atnam(3)='C3''', atnam(4)='C4''',
  r1= -115.0, r2= -65.0, r3= 5.0, r4= 30.0,
  rk2 =19.100, rk3 =19.100, &end
# DELTA (en B~+135, en A~+80)res 22
 &rst iresid=1, iat(1)=22,iat(2)=22,iat(3)=22,iat(4)=22, 
  atnam(1)='C5''', atnam(2)='C4''', atnam(3)='C3''', atnam(4)='O3''',
  r1=  75.0, r2=100.0, r3= 170.0, r4= 220.0, 
  rk2 =19.100, rk3 =19.100, &end
###
# gamma1 (en B~30, en A~-50) res 23  (23 em amber7)
 &rst iresid=1, iat(1)=23,iat(2)=23,iat(3)=23,iat(4)=23, 
  atnam(1)='O4''', atnam(2)='C1''', atnam(3)='C2''', atnam(4)='C3''',
  r1= -25.0, r2= 0.0, r3= 65.0, r4= 115.0, 
  rk2 =19.100, rk3 =19.100, &end
# gamma2 (en B~-30, en A~+45)res 23
 &rst iresid=1, iat(1)=23,iat(2)=23,iat(3)=23,iat(4)=23, 
  atnam(1)='C1''', atnam(2)='C2''', atnam(3)='C3''', atnam(4)='C4''',
  r1= -115.0, r2= -65.0, r3= 5.0, r4= 30.0,
  rk2 =19.100, rk3 =19.100, &end
# DELTA (en B~+135, en A~+80)res 23
 &rst iresid=1, iat(1)=23,iat(2)=23,iat(3)=23,iat(4)=23, 
  atnam(1)='C5''', atnam(2)='C4''', atnam(3)='C3''', atnam(4)='O3''',
  r1=  75.0, r2=100.0, r3= 170.0, r4= 220.0, 
  rk2 =19.100, rk3 =19.100, &end
#


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