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

635054 6ia0 34331 cing 1-original 1 AMBER stereochemistry chirality
# Restraints file 1: hTel_oxo10.RST
#####################
# Chirality restrains
#####################

#
#  chirality for residue 1 atoms:  C2' O4' N1 H1'
 &rst iat=27,8,11,10, 
   r1=10., r2=60., r3=80., r4=130., rk2 = 50., rk3=50.,  &end
bad constraint for residue 1 atoms:  C3' C1' H2'1 H2'2
#
#  chirality for residue 1 atoms:  O3' C2' C4' H3'
 &rst iat=30,27,6,26, &end
#
#  chirality for residue 1 atoms:  C3' C5' O4' H4'
 &rst iat=25,3,8,7, &end
bad constraint for residue 1 atoms:  C4' O5' H5'1 H5'2
#
#  chirality for residue 2 atoms:  C2' O4' N1 H1'
 &rst iat=59,40,43,42, &end
#
#  chirality for residue 2 atoms:  C3' C1' H2'1 H2'2
 &rst iat=57,41,60,61, &end
#
#  chirality for residue 2 atoms:  O3' C2' C4' H3'
 &rst iat=62,59,38,58, &end
#
#  chirality for residue 2 atoms:  C3' C5' O4' H4'
 &rst iat=57,35,40,39, &end
#
#  chirality for residue 2 atoms:  C4' O5' H5'1 H5'2
 &rst iat=38,34,36,37, &end
#
#  chirality for residue 3 atoms:  C2' O4' N9 H1'
 &rst iat=92,72,75,74, &end
#
#  chirality for residue 3 atoms:  C3' C1' H2'1 H2'2
 &rst iat=90,73,93,94, &end
#
#  chirality for residue 3 atoms:  O3' C2' C4' H3'
 &rst iat=95,92,70,91, &end
#
#  chirality for residue 3 atoms:  C3' C5' O4' H4'
 &rst iat=90,67,72,71, &end
#
#  chirality for residue 3 atoms:  C4' O5' H5'1 H5'2
 &rst iat=70,66,68,69, &end
#
#  chirality for residue 4 atoms:  C2' O4' N9 H1'
 &rst iat=125,105,108,107, &end
#
#  chirality for residue 4 atoms:  C3' C1' H2'1 H2'2
 &rst iat=123,106,126,127, &end
#
#  chirality for residue 4 atoms:  O3' C2' C4' H3'
 &rst iat=128,125,103,124, &end
#
#  chirality for residue 4 atoms:  C3' C5' O4' H4'
 &rst iat=123,100,105,104, &end
#
#  chirality for residue 4 atoms:  C4' O5' H5'1 H5'2
 &rst iat=103,99,101,102, &end
#
#  chirality for residue 5 atoms:  C2' O4' N9 H1'
 &rst iat=158,138,141,140, &end
#
#  chirality for residue 5 atoms:  C3' C1' H2'1 H2'2
 &rst iat=156,139,159,160, &end
#
#  chirality for residue 5 atoms:  O3' C2' C4' H3'
 &rst iat=161,158,136,157, &end
#
#  chirality for residue 5 atoms:  C3' C5' O4' H4'
 &rst iat=156,133,138,137, &end
#
#  chirality for residue 5 atoms:  C4' O5' H5'1 H5'2
 &rst iat=136,132,134,135, &end
#
#  chirality for residue 6 atoms:  C2' O4' N1 H1'
 &rst iat=190,171,174,173, &end
#
#  chirality for residue 6 atoms:  C3' C1' H2'1 H2'2
 &rst iat=188,172,191,192, &end
#
#  chirality for residue 6 atoms:  O3' C2' C4' H3'
 &rst iat=193,190,169,189, &end
#
#  chirality for residue 6 atoms:  C3' C5' O4' H4'
 &rst iat=188,166,171,170, &end
#
#  chirality for residue 6 atoms:  C4' O5' H5'1 H5'2
 &rst iat=169,165,167,168, &end
#
#  chirality for residue 7 atoms:  C2' O4' N1 H1'
 &rst iat=222,203,206,205, &end
#
#  chirality for residue 7 atoms:  C3' C1' H2'1 H2'2
 &rst iat=220,204,223,224, &end
#
#  chirality for residue 7 atoms:  O3' C2' C4' H3'
 &rst iat=225,222,201,221, &end
#
#  chirality for residue 7 atoms:  C3' C5' O4' H4'
 &rst iat=220,198,203,202, &end
#
#  chirality for residue 7 atoms:  C4' O5' H5'1 H5'2
 &rst iat=201,197,199,200, &end
#
#  chirality for residue 8 atoms:  C2' O4' N9 H1'
 &rst iat=254,235,238,237, &end
#
#  chirality for residue 8 atoms:  C3' C1' H2'1 H2'2
 &rst iat=252,236,255,256, &end
#
#  chirality for residue 8 atoms:  O3' C2' C4' H3'
 &rst iat=257,254,233,253, &end
#
#  chirality for residue 8 atoms:  C3' C5' O4' H4'
 &rst iat=252,230,235,234, &end
#
#  chirality for residue 8 atoms:  C4' O5' H5'1 H5'2
 &rst iat=233,229,231,232, &end
#
#  chirality for residue 9 atoms:  C2' O4' N9 H1'
 &rst iat=287,267,270,269, &end
#
#  chirality for residue 9 atoms:  C3' C1' H2'1 H2'2
 &rst iat=285,268,288,289, &end
#
#  chirality for residue 9 atoms:  O3' C2' C4' H3'
 &rst iat=290,287,265,286, &end
#
#  chirality for residue 9 atoms:  C3' C5' O4' H4'
 &rst iat=285,262,267,266, &end
#
#  chirality for residue 9 atoms:  C4' O5' H5'1 H5'2
 &rst iat=265,261,263,264, &end
#
#  chirality for residue 10 atoms:  C2' O4' N9 H1'
 &rst iat=321,300,303,302, &end
#
#  chirality for residue 10 atoms:  C3' C1' H2'1 H2'2
 &rst iat=319,301,322,323, &end
#
#  chirality for residue 10 atoms:  O3' C2' C4' H3'
 &rst iat=324,321,298,320, &end
#
#  chirality for residue 10 atoms:  C3' C5' O4' H4'
 &rst iat=319,295,300,299, &end
#
#  chirality for residue 10 atoms:  C4' O5' H5'1 H5'2
 &rst iat=298,294,296,297, &end
#
#  chirality for residue 11 atoms:  C2' O4' N9 H1'
 &rst iat=354,334,337,336, &end
#
#  chirality for residue 11 atoms:  C3' C1' H2'1 H2'2
 &rst iat=352,335,355,356, &end
#
#  chirality for residue 11 atoms:  O3' C2' C4' H3'
 &rst iat=357,354,332,353, &end
#
#  chirality for residue 11 atoms:  C3' C5' O4' H4'
 &rst iat=352,329,334,333, &end
#
#  chirality for residue 11 atoms:  C4' O5' H5'1 H5'2
 &rst iat=332,328,330,331, &end
#
#  chirality for residue 12 atoms:  C2' O4' N1 H1'
 &rst iat=386,367,370,369, &end
#
#  chirality for residue 12 atoms:  C3' C1' H2'1 H2'2
 &rst iat=384,368,387,388, &end
#
#  chirality for residue 12 atoms:  O3' C2' C4' H3'
 &rst iat=389,386,365,385, &end
#
#  chirality for residue 12 atoms:  C3' C5' O4' H4'
 &rst iat=384,362,367,366, &end
#
#  chirality for residue 12 atoms:  C4' O5' H5'1 H5'2
 &rst iat=365,361,363,364, &end
#
#  chirality for residue 13 atoms:  C2' O4' N1 H1'
 &rst iat=418,399,402,401, &end
#
#  chirality for residue 13 atoms:  C3' C1' H2'1 H2'2
 &rst iat=416,400,419,420, &end
#
#  chirality for residue 13 atoms:  O3' C2' C4' H3'
 &rst iat=421,418,397,417, &end
#
#  chirality for residue 13 atoms:  C3' C5' O4' H4'
 &rst iat=416,394,399,398, &end
#
#  chirality for residue 13 atoms:  C4' O5' H5'1 H5'2
 &rst iat=397,393,395,396, &end
#
#  chirality for residue 14 atoms:  C2' O4' N9 H1'
 &rst iat=450,431,434,433, &end
#
#  chirality for residue 14 atoms:  C3' C1' H2'1 H2'2
 &rst iat=448,432,451,452, &end
#
#  chirality for residue 14 atoms:  O3' C2' C4' H3'
 &rst iat=453,450,429,449, &end
#
#  chirality for residue 14 atoms:  C3' C5' O4' H4'
 &rst iat=448,426,431,430, &end
#
#  chirality for residue 14 atoms:  C4' O5' H5'1 H5'2
 &rst iat=429,425,427,428, &end
#
#  chirality for residue 15 atoms:  C2' O4' N9 H1'
 &rst iat=483,463,466,465, &end
#
#  chirality for residue 15 atoms:  C3' C1' H2'1 H2'2
 &rst iat=481,464,484,485, &end
#
#  chirality for residue 15 atoms:  O3' C2' C4' H3'
 &rst iat=486,483,461,482, &end
#
#  chirality for residue 15 atoms:  C3' C5' O4' H4'
 &rst iat=481,458,463,462, &end
#
#  chirality for residue 15 atoms:  C4' O5' H5'1 H5'2
 &rst iat=461,457,459,460, &end
#
#  chirality for residue 16 atoms:  C2' O4' N9 H1'
 &rst iat=516,496,499,498, &end
#
#  chirality for residue 16 atoms:  C3' C1' H2'1 H2'2
 &rst iat=514,497,517,518, &end
#
#  chirality for residue 16 atoms:  O3' C2' C4' H3'
 &rst iat=519,516,494,515, &end
#
#  chirality for residue 16 atoms:  C3' C5' O4' H4'
 &rst iat=514,491,496,495, &end
#
#  chirality for residue 16 atoms:  C4' O5' H5'1 H5'2
 &rst iat=494,490,492,493, &end
#
#  chirality for residue 17 atoms:  C2' O4' N9 H1'
 &rst iat=549,529,532,531, &end
#
#  chirality for residue 17 atoms:  C3' C1' H2'1 H2'2
 &rst iat=547,530,550,551, &end
#
#  chirality for residue 17 atoms:  O3' C2' C4' H3'
 &rst iat=552,549,527,548, &end
#
#  chirality for residue 17 atoms:  C3' C5' O4' H4'
 &rst iat=547,524,529,528, &end
#
#  chirality for residue 17 atoms:  C4' O5' H5'1 H5'2
 &rst iat=527,523,525,526, &end
#
#  chirality for residue 18 atoms:  C2' O4' N1 H1'
 &rst iat=581,562,565,564, &end
#
#  chirality for residue 18 atoms:  C3' C1' H2'1 H2'2
 &rst iat=579,563,582,583, &end
#
#  chirality for residue 18 atoms:  O3' C2' C4' H3'
 &rst iat=584,581,560,580, &end
#
#  chirality for residue 18 atoms:  C3' C5' O4' H4'
 &rst iat=579,557,562,561, &end
#
#  chirality for residue 18 atoms:  C4' O5' H5'1 H5'2
 &rst iat=560,556,558,559, &end
#
#  chirality for residue 19 atoms:  C2' O4' N1 H1'
 &rst iat=613,594,597,596, &end
#
#  chirality for residue 19 atoms:  C3' C1' H2'1 H2'2
 &rst iat=611,595,614,615, &end
#
#  chirality for residue 19 atoms:  O3' C2' C4' H3'
 &rst iat=616,613,592,612, &end
#
#  chirality for residue 19 atoms:  C3' C5' O4' H4'
 &rst iat=611,589,594,593, &end
#
#  chirality for residue 19 atoms:  C4' O5' H5'1 H5'2
 &rst iat=592,588,590,591, &end
#
#  chirality for residue 20 atoms:  C2' O4' N9 H1'
 &rst iat=645,626,629,628, &end
#
#  chirality for residue 20 atoms:  C3' C1' H2'1 H2'2
 &rst iat=643,627,646,647, &end
#
#  chirality for residue 20 atoms:  O3' C2' C4' H3'
 &rst iat=648,645,624,644, &end
#
#  chirality for residue 20 atoms:  C3' C5' O4' H4'
 &rst iat=643,621,626,625, &end
#
#  chirality for residue 20 atoms:  C4' O5' H5'1 H5'2
 &rst iat=624,620,622,623, &end
#
#  chirality for residue 21 atoms:  C2' O4' N9 H1'
 &rst iat=678,658,661,660, &end
#
#  chirality for residue 21 atoms:  C3' C1' H2'1 H2'2
 &rst iat=676,659,679,680, &end
#
#  chirality for residue 21 atoms:  O3' C2' C4' H3'
 &rst iat=681,678,656,677, &end
#
#  chirality for residue 21 atoms:  C3' C5' O4' H4'
 &rst iat=676,653,658,657, &end
#
#  chirality for residue 21 atoms:  C4' O5' H5'1 H5'2
 &rst iat=656,652,654,655, &end
#
#  chirality for residue 22 atoms:  C2' O4' N9 H1'
 &rst iat=711,691,694,693, &end
#
#  chirality for residue 22 atoms:  C3' C1' H2'1 H2'2
 &rst iat=709,692,712,713, &end
#
#  chirality for residue 22 atoms:  O3' C2' C4' H3'
 &rst iat=714,711,689,710, &end
#
#  chirality for residue 22 atoms:  C3' C5' O4' H4'
 &rst iat=709,686,691,690, &end
#
#  chirality for residue 22 atoms:  C4' O5' H5'1 H5'2
 &rst iat=689,685,687,688, &end
#
#  chirality for residue 23 atoms:  C2' O4' N9 H1'
 &rst iat=744,724,727,726, &end
#
#  chirality for residue 23 atoms:  C3' C1' H2'1 H2'2
 &rst iat=742,725,745,746, &end
#
#  chirality for residue 23 atoms:  O3' C2' C4' H3'
 &rst iat=747,744,722,743, &end
#
#  chirality for residue 23 atoms:  C3' C5' O4' H4'
 &rst iat=742,719,724,723, &end
#
#  chirality for residue 23 atoms:  C4' O5' H5'1 H5'2
 &rst iat=722,718,720,721, &end
#
#  chirality for residue 24 atoms:  C2' O4' N9 H1'
 &rst iat=776,757,760,759, &end
bad constraint for residue 24 atoms:  C3' C1' H2'1 H2'2
#
#  chirality for residue 24 atoms:  O3' C2' C4' H3'
 &rst iat=779,776,755,775, &end
#
#  chirality for residue 24 atoms:  C3' C5' O4' H4'
 &rst iat=774,752,757,756, &end
bad constraint for residue 24 atoms:  C4' O5' H5'1 H5'2
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Contact the webmaster for help, if required. Friday, May 3, 2024 2:44:12 PM GMT (wattos1)
image	mrblock_id	pdb_id	bmrb_id	cing	stage	position	program	type	subtype
	635054	6ia0	34331	cing	1-original	1	AMBER	stereochemistry	chirality