NMR Restraints Grid

Result table
(Save to zip file containing files for each block)

image mrblock_id pdb_id cing stage position program type subtype subsubtype

2929 1cur cing 1-original 2 AMBER distance hydrogen bond simple

#   hydrogen bond constraints:
#
#
# 8   LYS  HN	122   TYR  O	1.8	2.6
 &rst iat= 107,1844, r1= 1.30, r2= 1.80, r3= 2.60, r4= 3.10, 
      rk2=20.0, rk3=20.0, ir6=1,
 &end
#
# 10   ALA  HN	120   PHE  O	1.8	2.6
 &rst iat= 145,1816, r1= 1.30, r2= 1.80, r3= 2.60, r4= 3.10,  &end
#
# 25   LYS  HN	32   THR  O	1.8	2.6
 &rst iat= 377, 488, r1= 1.30, r2= 1.80, r3= 2.60, r4= 3.10,  &end
#
# 31   VAL  HN	63   THR  O	1.8	2.6
 &rst iat= 460, 963, r1= 1.30, r2= 1.80, r3= 2.60, r4= 3.10,  &end
#
# 32   THR  HN	25   LYS  O	1.8	2.6
 &rst iat= 476, 397, r1= 1.30, r2= 1.80, r3= 2.60, r4= 3.10,  &end
#
# 33   TYR  HN	65   GLU  O	1.8	2.6
 &rst iat= 490, 998, r1= 1.30, r2= 1.80, r3= 2.60, r4= 3.10,  &end
#
# 40   VAL  HN	73   ASP  O	1.8	2.6
 &rst iat= 599,1101, r1= 1.30, r2= 1.80, r3= 2.60, r4= 3.10,  &end
#
## 42   ALA  HN	75   THR  O	1.8	2.6
##&rst iat= 631,1131, r1= 1.30, r2= 1.80, r3= 2.60, r4= 3.10,  &end 1/17/96.
#
# 43   ALA  HN	55   GLU  O	1.8	2.6
 &rst iat= 641, 830, r1= 1.30, r2= 1.80, r3= 2.60, r4= 3.10,  &end
#
# 44   ALA  HN	77   ILE  O	1.8	2.6
 &rst iat= 651,1170, r1= 1.30, r2= 1.80, r3= 2.60, r4= 3.10,  &end
#
##54   PHE  HN	61   ASN  O	1.8	2.6
##rst iat= 796, 935, r1= 1.30, r2= 1.80, r3= 2.60, r4= 3.10,  &end
#
# 55   GLU  HN	43   ALA  O	1.8	2.6
 &rst iat= 816, 649, r1= 1.30, r2= 1.80, r3= 2.60, r4= 3.10,  &end
#
# 56   VAL  HN	59   LYS  O	1.8	2.6
 &rst iat= 832, 899, r1= 1.30, r2= 1.80, r3= 2.60, r4= 3.10,  &end
#
# 59   LYS  HN	56   VAL  O	1.8	2.6
 &rst iat= 879, 846, r1= 1.30, r2= 1.80, r3= 2.60, r4= 3.10,  &end
#
# 61   ASN  HN	54   PHE  O	1.8	2.6
 &rst iat= 923, 814, r1= 1.30, r2= 1.80, r3= 2.60, r4= 3.10,  &end
#
# 64   LEU  HN	151   LYS  O	1.8	2.6
 &rst iat= 965,2280, r1= 1.30, r2= 1.80, r3= 2.60, r4= 3.10,  &end
#
# 65   GLU  HN	31   VAL  O	1.8	2.6
 &rst iat= 984, 474, r1= 1.30, r2= 1.80, r3= 2.60, r4= 3.10,  &end
#
# 66   ILE  HN	153   VAL  O	1.8	2.6
 &rst iat=1000,2315, r1= 1.30, r2= 1.80, r3= 2.60, r4= 3.10,  &end
#
# 72   VAL  HN	127   TRP  O	1.8	2.6
 &rst iat=1074,1929, r1= 1.30, r2= 1.80, r3= 2.60, r4= 3.10,  &end
#
# 73   ASP  HN	38   VAL  O	1.8	2.6
 &rst iat=1090, 579, r1= 1.30, r2= 1.80, r3= 2.60, r4= 3.10,  &end
#
# 74   VAL  HN	125   PHE  O	1.8	2.6
 &rst iat=1103,1891, r1= 1.30, r2= 1.80, r3= 2.60, r4= 3.10,  &end
#
# 75   THR  HN	40   VAL  O	1.8	2.6
 &rst iat=1119, 613, r1= 1.30, r2= 1.80, r3= 2.60, r4= 3.10,  &end
#
# 76   PHE  HN	123   THR  O	1.8	2.6
 &rst iat=1133,1858, r1= 1.30, r2= 1.80, r3= 2.60, r4= 3.10,  &end
#
# 77   ILE  HN	42   ALA  O	1.8	2.6
 &rst iat=1153, 639, r1= 1.30, r2= 1.80, r3= 2.60, r4= 3.10,  &end
#
# 78   ASN  HN	121   GLY  O	1.8	2.6
 &rst iat=1172,1823, r1= 1.30, r2= 1.80, r3= 2.60, r4= 3.10,  &end
#
# 87   PHE  HN	109   THR  O	1.8	2.6
## &rst iat=1299,1650, r1= 1.30, r2= 1.80, r3= 2.60, r4= 3.10,  &end 1/31/96
##   acceptor may be OG or 109 rather than backbone O
#
# 88   ASP  HN	137   VAL  O	1.8	2.6
 &rst iat=1319,2085, r1= 1.30, r2= 1.80, r3= 2.60, r4= 3.10,  &end
#
# 89   ILE  HN	107   ALA  O	1.8	2.6
 &rst iat=1332,1629, r1= 1.30, r2= 1.80, r3= 2.60, r4= 3.10,  &end
#
# 90   THR  HN	135   TYR  O	1.8	2.6
 &rst iat=1351,2048, r1= 1.30, r2= 1.80, r3= 2.60, r4= 3.10,  &end
#
##120   PHE  HN	10   ALA  O	1.8	2.6
##rst iat=1798, 153, r1= 1.30, r2= 1.80, r3= 2.60, r4= 3.10,  &end
#
# 122   TYR  HN	8   LYS  O	1.8	2.6
 &rst iat=1825, 127, r1= 1.30, r2= 1.80, r3= 2.60, r4= 3.10,  &end
#
# 123   THR  HN	76   PHE  O	1.8	2.6
 &rst iat=1846,1151, r1= 1.30, r2= 1.80, r3= 2.60, r4= 3.10,  &end
#
# 125   PHE  HN	74   VAL  O	1.8	2.6
 &rst iat=1873,1117, r1= 1.30, r2= 1.80, r3= 2.60, r4= 3.10,  &end
#
# 127   TRP  HN	72   VAL  O	1.8	2.6
 &rst iat=1907,1088, r1= 1.30, r2= 1.80, r3= 2.60, r4= 3.10,  &end
#
# 134   TYR  HN	152   ILE  O	1.8	2.6
 &rst iat=2008,2299, r1= 1.30, r2= 1.80, r3= 2.60, r4= 3.10,  &end
#
# 135   TYR  HN	90   THR  O	1.8	2.6
 &rst iat=2029,1363, r1= 1.30, r2= 1.80, r3= 2.60, r4= 3.10,  &end
#
# 136   TYR  HN	150   GLY  O	1.8	2.6
 &rst iat=2050,2258, r1= 1.30, r2= 1.80, r3= 2.60, r4= 3.10,  &end
#
# 137   VAL  HN	88   ASP  O	1.8	2.6
 &rst iat=2071,1330, r1= 1.30, r2= 1.80, r3= 2.60, r4= 3.10,  &end
#
##138   CYS  HN	148   MET  O	1.8	2.6
##rst iat=2087,2231, r1= 1.30, r2= 1.80, r3= 2.60, r4= 3.10,  &end
#
##148   MET  HN	138   CYS  O	1.8	2.6
##rst iat=2214,2097, r1= 1.30, r2= 1.80, r3= 2.60, r4= 3.10,  &end
#
# 150   GLY  HN	136   TYR  O	1.8	2.6
 &rst iat=2253,2069, r1= 1.30, r2= 1.80, r3= 2.60, r4= 3.10,  &end
#
##151   LYS  HN	62   PRO  O	1.8	2.6
##rst iat=2260, 949, r1= 1.30, r2= 1.80, r3= 2.60, r4= 3.10,  &end
#
# 152   ILE  HN	134   TYR  O	1.8	2.6
 &rst iat=2282,2027, r1= 1.30, r2= 1.80, r3= 2.60, r4= 3.10,  &end
#
# 153   VAL  HN	64   LEU  O	1.8	2.6
 &rst iat=2301, 982, r1= 1.30, r2= 1.80, r3= 2.60, r4= 3.10,  &end
#
##154   VAL  HN	132   GLY  O	1.8	2.6
##rst iat=2317,1992, r1= 1.30, r2= 1.80, r3= 2.60, r4= 3.10,  &end
#
# 15 VAL HN  11 THR O		1.8	2.6
 &rst iat= 219, 167, r1= 1.30, r2= 1.80, r3= 2.60, r4= 3.10,  &end
#
# 18 MET HN  14 GLN O		1.8	2.6
 &rst iat= 267, 217, r1= 1.30, r2= 1.80, r3= 2.60, r4= 3.10,  &end
#
# 21 LYS HN  17 ALA O		1.8	2.6
## &rst iat= 321, 265, r1= 1.30, r2= 1.80, r3= 2.60, r4= 3.10,  &end 1/31/96
##   may be a 1-3 rather than a 1-4 hydrogen bond.
#
#

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image	mrblock_id	pdb_id	cing	stage	position	program	type	subtype	subsubtype
	2929	1cur	cing	1-original	2	AMBER	distance	hydrogen bond	simple