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

616723 5m1l 34051 cing 1-original 2 AMBER dihedral angle
# Restraints file 2: torsion.txt
# torsion angle restraint
# 1 GUA CHI:  (1 DG5 O4')-(1 DG5 C1')-(1 DG5 N9)-(1 DG5 C4) 200.0 280.0
 &rst     iat =     8,     9,    11,    25,
	  r1 = 199.0, r2 = 200.0, r3 = 280.0, r4 = 281.0,
	  rk2 =   200.0, rk3 =   200.0,				&end

# 2 CYT CHI:  (2 DC O4')-(2 DC C1')-(2 DC N1)-(2 DC C2) 170.0 310.0
 &rst     iat =    41,    42,    44,    54,
	  r1 = 169.0, r2 = 170.0, r3 = 310.0, r4 = 311.0,
	&end

# 3 GUA CHI:  (3 DG O4')-(3 DG C1')-(3 DG N9)-(3 DG C4) 200.0 280.0
 &rst     iat =    71,    72,    74,    88,
	  r1 = 170.0, r2 = 200.0, r3 = 280.0, r4 = 281.0,
	&end

# 4 ADE CHI:  (4 DA O4')-(4 DA C1')-(4 DA N9)-(4 DA C4) 200.0 280.0
 &rst     iat =   104,   105,   107,   120,
	  r1 = 170.0, r2 = 200.0, r3 = 280.0, r4 = 281.0,
	&end

# 5 GUA CHI:  (5 DG O4')-(5 DG C1')-(5 DG N9)-(5 DG C4) 200.0 280.0
 &rst     iat =   136,   137,   139,   153,
	  r1 = 199.0, r2 = 200.0, r3 = 280.0, r4 = 281.0,
	&end

# 6 GUA CHI:  (6 DG O4')-(6 DG C1')-(6 DG N9)-(6 DG C4) 200.0 280.0
 &rst     iat =   169,   170,   172,   186,
	  r1 = 199.0, r2 = 200.0, r3 = 280.0, r4 = 281.0,
	&end

# 7 GUA CHI:  (7 DG O4')-(7 DG C1')-(7 DG N9)-(7 DG C4) 200.0 280.0
 &rst     iat =   202,   203,   205,   219,
	  r1 = 199.0, r2 = 200.0, r3 = 280.0, r4 = 281.0,
	&end

# 8 ADE CHI:  (8 DA O4')-(8 DA C1')-(8 DA N9)-(8 DA C4) 200.0 280.0
 &rst     iat =   235,   236,   238,   251,
	  r1 = 199.0, r2 = 200.0, r3 = 280.0, r4 = 281.0,
	&end

# 9 GUA CHI:  (9 DG O4')-(9 DG C1')-(9 DG N9)-(9 DG C4) 200.0 280.0
 &rst     iat =   267,   268,   270,   284,
	  r1 = 199.0, r2 = 200.0, r3 = 280.0, r4 = 281.0,
	&end

# 10 CYT CHI:  (10 DC O4')-(10 DC C1')-(10 DC N1)-(10 DC C2) 170.0 310.0
 &rst     iat =   300,   301,   303,   313,
	  r1 = 169.0, r2 = 170.0, r3 = 310.0, r4 = 311.0,
	&end

# 11 GUA CHI:  (11 DG O4')-(11 DG C1')-(11 DG N9)-(11 DG C4) 200.0 280.0
 &rst     iat =   330,   331,   333,   347,
	  r1 = 170.0, r2 = 200.0, r3 = 280.0, r4 = 281.0,
	&end

# 12 ADE CHI:  (12 DA O4')-(12 DA C1')-(12 DA N9)-(12 DA C4) 200.0 280.0
 &rst     iat =   363,   364,   366,   379,
	  r1 = 170.0, r2 = 200.0, r3 = 280.0, r4 = 281.0,
	&end

# 13 GUA CHI:  (13 DG O4')-(13 DG C1')-(13 DG N9)-(13 DG C4) 200.0 280.0
 &rst     iat =   395,   396,   398,   412,
	  r1 = 199.0, r2 = 200.0, r3 = 280.0, r4 = 281.0,
	&end

# 14 GUA CHI:  (14 DG O4')-(14 DG C1')-(14 DG N9)-(14 DG C4) 200.0 280.0
 &rst     iat =   428,   429,   431,   445,
	  r1 = 199.0, r2 = 200.0, r3 = 280.0, r4 = 281.0,
	&end

# 15 GUA CHI:  (15 DG3 O4')-(15 DG3 C1')-(15 DG3 N9)-(15 DG3 C4) 200.0 280.0
 &rst     iat =   461,   462,   464,   478,
	  r1 = 199.0, r2 = 200.0, r3 = 280.0, r4 = 281.0,
	&end

# 16 GUA CHI:  (16 DG5 O4')-(16 DG5 C1')-(16 DG5 N9)-(16 DG5 C4) 200.0 280.0
 &rst     iat =   493,   494,   496,   510,
	  r1 = 199.0, r2 = 200.0, r3 = 280.0, r4 = 281.0,
	&end

# 17 CYT CHI:  (17 DC O4')-(17 DC C1')-(17 DC N1)-(17 DC C2) 170.0 310.0
 &rst     iat =   526,   527,   529,   539,
	  r1 = 169.0, r2 = 170.0, r3 = 310.0, r4 = 311.0,
	&end

# 18 GUA CHI:  (18 DG O4')-(18 DG C1')-(18 DG N9)-(18 DG C4) 200.0 280.0
 &rst     iat =   556,   557,   559,   573,
	  r1 = 170.0, r2 = 200.0, r3 = 280.0, r4 = 281.0,
	&end

# 19 ADE CHI:  (19 DA O4')-(19 DA C1')-(19 DA N9)-(19 DA C4) 200.0 280.0
 &rst     iat =   589,   590,   592,   605,
	  r1 = 170.0, r2 = 200.0, r3 = 280.0, r4 = 281.0,
	&end

# 20 GUA CHI:  (20 DG O4')-(20 DG C1')-(20 DG N9)-(20 DG C4) 200.0 280.0
 &rst     iat =   621,   622,   624,   638,
	  r1 = 199.0, r2 = 200.0, r3 = 280.0, r4 = 281.0,
	&end

# 21 GUA CHI:  (21 DG O4')-(21 DG C1')-(21 DG N9)-(21 DG C4) 200.0 280.0
 &rst     iat =   654,   655,   657,   671,
	  r1 = 199.0, r2 = 200.0, r3 = 280.0, r4 = 281.0,
	&end

# 22 GUA CHI:  (22 DG O4')-(22 DG C1')-(22 DG N9)-(22 DG C4) 200.0 280.0
 &rst     iat =   687,   688,   690,   704,
	  r1 = 199.0, r2 = 200.0, r3 = 280.0, r4 = 281.0,
	&end

# 23 ADE CHI:  (23 DA O4')-(23 DA C1')-(23 DA N9)-(23 DA C4) 200.0 280.0
 &rst     iat =   720,   721,   723,   736,
	  r1 = 199.0, r2 = 200.0, r3 = 280.0, r4 = 281.0,
	&end

# 24 GUA CHI:  (24 DG O4')-(24 DG C1')-(24 DG N9)-(24 DG C4) 200.0 280.0
 &rst     iat =   752,   753,   755,   769,
	  r1 = 199.0, r2 = 200.0, r3 = 280.0, r4 = 281.0,
	&end

# 25 CYT CHI:  (25 DC O4')-(25 DC C1')-(25 DC N1)-(25 DC C2) 170.0 310.0
 &rst     iat =   785,   786,   788,   798,
	  r1 = 169.0, r2 = 170.0, r3 = 310.0, r4 = 311.0,
	&end

# 26 GUA CHI:  (26 DG O4')-(26 DG C1')-(26 DG N9)-(26 DG C4) 200.0 280.0
 &rst     iat =   815,   816,   818,   832,
	  r1 = 199.0, r2 = 200.0, r3 = 280.0, r4 = 281.0,
	&end

# 27 ADE CHI:  (27 DA O4')-(27 DA C1')-(27 DA N9)-(27 DA C4) 200.0 280.0
 &rst     iat =   848,   849,   851,   864,
	  r1 = 170.0, r2 = 200.0, r3 = 280.0, r4 = 281.0,
	&end

# 28 GUA CHI:  (28 DG O4')-(28 DG C1')-(28 DG N9)-(28 DG C4) 200.0 280.0
 &rst     iat =   880,   881,   883,   897,
	  r1 = 170.0, r2 = 200.0, r3 = 280.0, r4 = 281.0,
	&end

# 29 GUA CHI:  (29 DG O4')-(29 DG C1')-(29 DG N9)-(29 DG C4) 200.0 280.0
 &rst     iat =   913,   914,   916,   930,
	  r1 = 199.0, r2 = 200.0, r3 = 280.0, r4 = 281.0,
	&end

# 30 GUA CHI:  (30 DG3 O4')-(30 DG3 C1')-(30 DG3 N9)-(30 DG3 C4) 200.0 280.0
 &rst     iat =   946,   947,   949,   963,
	  r1 = 199.0, r2 = 200.0, r3 = 280.0, r4 = 281.0,
	&end# Restraints file 3: hydrogen_bond.txt
Please acknowledge these references in publications where the data from this site have been utilized.
Contact the webmaster for help, if required. Monday, May 6, 2024 12:41:13 PM GMT (wattos1)
image	mrblock_id	pdb_id	bmrb_id	cing	stage	position	program	type
	616723	5m1l	34051	cing	1-original	2	AMBER	dihedral angle