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 subsubtype

623120 6ba6 30353 cing 1-original 5 XPLOR/CNS distance NOE simple
# Restraints file 5: talin-rap1-inter-noes-2.xtb
!@ BEGIN_XPLR_PCK_SUM
! LBL   File-Name                             All  Intra   Seq.  Short   Long  InterM
! A   complexf.03.xtb                          23     0      0      0     23      0
! B   nc-noesy.new                             18     0      0      0     18      0
!    Total                                     41     0      0      0     41      0

!@ END_XPLR_PCK_SUM

!@ BEGIN_XPLR_NOE_FILE
! M1

! V2

! A3

! L4

! S5

! L6

! K7

! I8

! S9

! I10

! G11

! N12
assign (resid  12 and name   HA) (resid 141 and name  HB1)  4.0  2.2  1.0 ! A.1    at -1.53e+06
assign (resid  12 and name   HA) (resid 141 and name  HG1)  3.0  1.2  0.3 ! A.2    at -2.46e+06

! V13
assign (resid  13 and name HG1#) (resid 124 and name   HB)  2.5  0.7  1.3 ! B.3    at -3.07e+06

! V14
assign (resid  14 and name   HB) (resid 139 and name  HB1)  3.0  1.2  0.3 ! A.3    at -3.92e+06
assign (resid  14 and name HG1#) (resid 139 and name  HB1)  4.0  2.2  2.5 ! A.4    at -7.85e+06
assign (resid  14 and name HG2#) (resid 139 and name  HB1)  3.0  1.2  0.8 ! A.5    at -3.56e+06

! K15

! T16
assign (resid  16 and name HG2#) (resid 136 and name HD1#)  2.5  0.7  1.2 ! A.6    at -7.71e+06
assign (resid  16 and name HG2#) (resid 136 and name HG2#)  3.0  1.2  1.3 ! A.7    at -4.65e+06
assign (resid  16 and name   HB) (resid 136 and name HD1#)  2.5  0.7  0.7 ! B.7    at -1.82e+06
assign (resid  16 and name HG2#) (resid 136 and name HG12)  3.0  1.2  1.1 ! B.9    at -3.47e+06
assign (resid  16 and name HG2#) (resid 137 and name  HB1)  3.0  1.2  0.8 ! A.8    at -2.11e+06
!assign (resid  16 and name HG2#) (resid 166 and name  HB#)  4.0  2.2  2.5 ! B.12   at -3.66e+06  removed
assign (resid  16 and name HG2#) (resid 167 and name  HB1)  4.0  2.2  2.8 ! B.13   at -6.30e+06 !! relaxed

! M17
assign (resid  17 and name   HA) (resid 136 and name HD1#)  3.0  1.2  0.8 ! A.9    at -2.10e+06

! Q18
assign (resid  18 and name  HB1) (resid 136 and name HD1#)  4.0  2.2  1.5 ! A.10   at -1.33e+06
assign (resid  18 and name  HG1) (resid 136 and name HD1#)  2.5  0.7  0.7 ! A.11   at -5.41e+06

! F19

! E20

! P21

! S22

! T23

! M24

! V25

! Y26

! D27

! A28

! C29

! R30

! M31

! I32

! R33

! E34

! R35

! I36
assign (resid  36 and name   HA) (resid 127 and name HD1#)  4.0  2.2  1.5 ! A.12   at -1.65e+06
assign (resid  36 and name HD1#) (resid 127 and name HD1#)  2.5  0.7  1.2 ! A.14   at -5.00e+06
assign (resid  36 and name HD1#) (resid 127 and name HG11)  3.0  1.2  0.8 ! A.15   at -2.21e+06
assign (resid  36 and name HD1#) (resid 127 and name   HB)  3.0  1.2  1.2 ! B.19   at -1.45e+06
assign (resid  36 and name   HA) (resid 129 and name HG1#)  4.0  2.2  1.5 ! A.13   at -1.65e+06
assign (resid  36 and name HD1#) (resid 129 and name HG1#)  3.0  1.2  1.4 ! B.22   at -3.40e+06
assign (resid  36 and name HD1#) (resid 133 and name   HA)  2.5  0.7  1.3 ! B.23   at -1.55e+06

! P37
assign (resid  37 and name  HB1) (resid 127 and name HD1#)  3.0  1.2  0.8 ! A.16   at -3.88e+06
assign (resid  37 and name  HB2) (resid 127 and name HD1#)  2.5  0.7  0.7 ! A.17   at -6.29e+06
assign (resid  37 and name  HD1) (resid 127 and name HG2#)  4.0  2.2  2.5 ! A.18   at -1.19e+06
assign (resid  37 and name  HG1) (resid 127 and name HD1#)  3.0  1.2  0.8 ! A.20   at -3.05e+06
assign (resid  37 and name  HG2) (resid 127 and name HD1#)  3.0  1.2  0.8 ! A.21   at -3.62e+06
assign (resid  37 and name   HA) (resid 127 and name HD1#)  2.5  0.7  1.5 ! B.24   at -2.97e+06
assign (resid  37 and name  HB2) (resid 127 and name HG2#)  2.5  0.7  0.7 ! B.28   at -6.15e+06
assign (resid  37 and name  HG2) (resid 127 and name HG2#)  2.5  0.7  0.7 ! B.35   at -3.62e+06
assign (resid  37 and name  HD1) (resid 129 and name   HA)  4.0  2.2  1.0 ! A.19   at -1.62e+06
assign (resid  37 and name  HG1) (resid 129 and name HG2#)  3.0  1.2  0.8 ! A.23   at -3.05e+06
assign (resid  37 and name  HG2) (resid 129 and name HG1#)  3.0  1.2  0.8 ! A.22   at -3.62e+06
assign (resid  37 and name   HA) (resid 129 and name HG1#)  2.5  0.7  1.4 ! B.25   at -2.97e+06
assign (resid  37 and name  HB1) (resid 129 and name HG1#)  2.5  0.7  1.4 ! B.29   at -3.88e+06
assign (resid  37 and name  HD1) (resid 129 and name HG1#)  2.5  0.7  0.7 ! B.32   at -1.19e+06

! E38
assign (resid  38 and name   HA) (resid 127 and name HD1#)  2.5  0.7  0.7 ! B.38   at -2.26e+06

! A39
assign (resid  39 and name  HB#) (resid 127 and name HD1#)  4.0  2.2  1.1 ! B.39   at -5.62e+06

! L40
assign (resid  40 and name HD1#) (resid 127 and name HD1#)  4.0  2.2  3.0 ! B.40   at -1.33e+07
assign (resid  40 and name HD2#) (resid 129 and name HG2#)  3.0  1.2  1.9 ! B.41   at -3.48e+06

! A41

! G42

! P43

! P44

! N45

! D46

! F47

! G48

! L49

! F50

! L51

! S52

! D53

! D54

! D55

! P56

! K57

! K58

! G59

! I60

! W61

! L62

! E63

! A64

! G65

! K66

! A67

! L68

! D69

! Y70

! Y71

! M72

! L73

! R74

! N75

! G76

! D77

! T78

! M79

! E80

! Y81

! R82

! K83

! K84

! Q85

! R86

! G87

! G88

! G89

! G90

! G91

! G92

! G93

! G94

! G95

! G96

! G97

! G98

! G99

! G100

! M101

! R102

! E103

! Y104

! K105

! L106

! V107

! V108

! L109

! G110

! S111

! V112

! G113

! V114

! G115

! K116

! S117

! A118

! L119

! T120

! V121

! Q122

! F123

! V124

! Q125

! G126

! I127

! F128

! V129

! E130

! K131

! Y132

! D133

! P134

! T135

! I136

! E137

! D138

! S139

! Y140

! R141

! K142

! Q143

! V144

! E145

! V146

! D147

! A148

! Q149

! Q150

! C151

! M152

! L153

! E154

! I155

! L156

! D157

! T158

! A159

! G160

! T161

! E162

! Q163

! F164

! T165

! A166

! M167

! R168

! D169

! L170

! Y171

! M172

! K173

! N174

! G175

! Q176

! G177

! F178

! A179

! L180

! V181

! Y182

! S183

! I184

! T185

! A186

! Q187

! S188

! T189

! F190

! N191

! D192

! L193

! Q194

! D195

! L196

! R197

! E198

! Q199

! I200

! L201

! R202

! V203

! K204

! D205

! T206

! D207

! D208

! V209

! P210

! M211

! I212

! L213

! V214

! G215

! N216

! K217

! C218

! D219

! L220

! E221

! D222

! E223

! R224

! V225

! V226

! G227

! K228

! E229

! Q230

! G231

! Q232

! N233

! L234

! A235

! R236

! Q237

! W238

! N239

! N240

! C241

! A242

! F243

! L244

! E245

! S246

! S247

! A248

! K249

! S250

! K251

! I252

! N253

! V254

! N255

! E256

! I257

! F258

! Y259

! D260

! L261

! V262

! R263

! Q264

! I265

! N266

! R267

!@ END_XPLR_NOE_FILE
Please acknowledge these references in publications where the data from this site have been utilized.
Contact the webmaster for help, if required. Thursday, May 2, 2024 8:12:21 PM GMT (wattos1)
image	mrblock_id	pdb_id	bmrb_id	cing	stage	position	program	type	subtype	subsubtype
	623120	6ba6	30353	cing	1-original	5	XPLOR/CNS	distance	NOE	simple