NMR Restraints Grid

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

image mrblock_id pdb_id cing stage position program type
2994 1d18 cing 1-original 9 MR format nomenclature mapping


  Entry H atom name              Orig H atom name
  Start of MODEL            1
  Start of ATOM             2
 Raw file had 183 H/Q atoms
  No match found for entry  H5*  C           1
    1   1H5*    C   1          H51*  C     1   5.930   6.530  14.000
    2   2H5*    C   1          H52*  C     1   6.230   7.820  12.850
    3    H4*    C   1           H4*  C     1   7.430   5.740  12.260
    4    H3*    C   1           H3*  C     1   5.520   7.120  10.500
    5   1H2*    C   1          H21*  C     1   4.750   5.200   9.480
    6   2H2*    C   1          H22*  C     1   6.400   4.880   8.980
    7    H1*    C   1           H1*  C     1   6.770   3.430  10.790
    8   1H4     C   1           H41  C     1   1.980  -0.710  10.810
    9   2H4     C   1           H42  C     1   0.820   0.480  10.940
   10    H5     C   1            H5  C     1   1.330   2.780  10.970
   11    H6     C   1            H6  C     1   3.150   4.470  11.030
   12   1H5*    A   2          H51*  A     2   9.430   5.140   9.350
   13   2H5*    A   2          H52*  A     2  10.290   5.990   8.070
   14    H4*    A   2           H4*  A     2  10.580   3.560   7.870
   15    H3*    A   2           H3*  A     2   9.640   5.310   5.800
   16   1H2*    A   2          H21*  A     2   7.650   4.160   5.380
   17   2H2*    A   2          H22*  A     2   8.710   3.000   4.590
   18    H1*    A   2           H1*  A     2   8.790   1.590   6.470
   19    H8     A   2            H8  A     2   5.760   4.030   6.620
   20   1H6     A   2           H61  A     2   2.540   0.770   7.790
   21   2H6     A   2           H62  A     2   2.430  -0.890   7.730
   22    H2     A   2            H2  A     2   6.550  -2.340   6.560
   23   1H5*    T   3          H51*  T     3  11.470   1.370   4.250
   24   2H5*    T   3          H52*  T     3  12.250   1.600   2.690
   25    H4*    T   3           H4*  T     3  10.700  -0.300   2.640
   26    H3*    T   3           H3*  T     3  10.550   2.010   0.860
   27   1H2*    T   3          H21*  T     3   8.200   2.110   0.920
   28   2H2*    T   3          H22*  T     3   8.250   0.570   0.090
   29    H1*    T   3           H1*  T     3   8.060  -0.660   2.100
   30    H3     T   3            H3  T     3   3.850  -0.260   3.670
   31   1H5M    T   3           H71  T     3   4.230   4.520   3.130
   32   2H5M    T   3           H72  T     3   4.950   4.260   4.740
   33   3H5M    T   3           H73  T     3   6.000   4.660   3.340
   34    H6     T   3            H6  T     3   7.200   2.990   2.560
   35   1H5*    G   4          H51*  G     4   9.680  -2.320   0.150
   36   2H5*    G   4          H52*  G     4  10.100  -2.940  -1.440
   37    H4*    G   4           H4*  G     4   8.100  -4.060  -0.510
   38    H3*    G   4           H3*  G     4   8.310  -2.930  -3.110
   39   1H2*    G   4          H21*  G     4   6.660  -1.300  -2.800
   40   2H2*    G   4          H22*  G     4   5.620  -2.660  -3.180
   41    H1*    G   4           H1*  G     4   5.270  -3.200  -0.880
   42    H8     G   4            H8  G     4   6.230   0.540  -1.410
   43    H1     G   4            H1  G     4   0.560  -0.540   1.370
   44   1H2     G   4           H21  G     4   0.120  -2.860   1.200
   45   2H2     G   4           H22  G     4   1.270  -3.890   0.570
   46   1H5*    C   5          H51*  C     5   5.040  -5.780  -1.540
   47   2H5*    C   5          H52*  C     5   4.790  -7.090  -2.690
   48    H4*    C   5           H4*  C     5   2.730  -6.630  -1.470
   49    H3*    C   5           H3*  C     5   2.980  -6.720  -4.260
   50   1H2*    C   5          H21*  C     5   2.290  -4.460  -4.660
   51   2H2*    C   5          H22*  C     5   0.700  -5.190  -4.440
   52    H1*    C   5           H1*  C     5   0.630  -4.530  -2.150
   53   1H4     C   5           H41  C     5   1.200   1.780  -2.420
   54   2H4     C   5           H42  C     5   2.610   1.710  -3.300
   55    H5     C   5            H5  C     5   3.590  -0.330  -4.020
   56    H6     C   5            H6  C     5   3.420  -2.790  -3.970
   57   1H5*    A   6          H51*  A     6  -0.900  -6.620  -1.890
   58   2H5*    A   6          H52*  A     6  -1.910  -7.960  -2.410
   59    H4*    A   6           H4*  A     6  -3.300  -6.150  -1.560
   60    H3*    A   6           H3*  A     6  -3.640  -7.380  -4.070
   61   1H2*    A   6          H21*  A     6  -3.050  -5.420  -5.360
   62   2H2*    A   6          H22*  A     6  -4.760  -5.120  -5.090
   63    H1*    A   6           H1*  A     6  -4.310  -3.750  -3.180
   64    H8     A   6            H8  A     6  -1.240  -3.960  -5.550
   65   1H6     A   6           H61  A     6  -0.170   0.660  -5.170
   66   2H6     A   6           H62  A     6  -1.000   2.050  -4.790
   67    H2     A   6            H2  A     6  -5.060   0.720  -3.340
   68   1H5*    T   7          H51*  T     7  -7.350  -4.710  -2.790
   69   2H5*    T   7          H52*  T     7  -8.810  -5.400  -3.490
   70    H4*    T   7           H4*  T     7  -8.660  -3.020  -4.000
   71    H3*    T   7           H3*  T     7  -8.700  -5.090  -6.110
   72   1H2*    T   7          H21*  T     7  -7.410  -3.810  -7.540
   73   2H2*    T   7          H22*  T     7  -8.710  -2.610  -7.470
   74    H1*    T   7           H1*  T     7  -7.690  -1.410  -5.730
   75    H3     T   7            H3  T     7  -4.140   0.830  -7.330
   76   1H5M    T   7           H71  T     7  -2.770  -3.150  -9.490
   77   2H5M    T   7           H72  T     7  -1.960  -3.460  -7.930
   78   3H5M    T   7           H73  T     7  -3.420  -4.380  -8.380
   79    H6     T   7            H6  T     7  -5.230  -3.840  -7.260
   80   1H5*    G   8          H51*  G     8 -10.930  -1.160  -5.990
   81   2H5*    G   8          H52*  G     8 -12.460  -1.110  -6.850
   82    H4*    G   8           H4*  G     8 -11.160   0.940  -7.220
   83    H3*    G   8           H3*  G     8 -12.300  -0.690  -9.280
   84   1H2*    G   8          H21*  G     8 -10.150  -1.170 -10.330
   85   2H2*    G   8          H22*  G     8 -10.440   0.420 -11.020
   86    H1*    G   8           H1*  G     8  -9.270   1.510  -9.270
   87    H8     G   8            H8  G     8  -8.000  -2.110  -9.910
   88    H1     G   8            H1  G     8  -3.780   2.670 -10.660
   89   1H2     G   8           H21  G     8  -4.960   4.710 -10.310
   90   2H2     G   8           H22  G     8  -6.570   4.680  -9.910
   91    H3*    G   8            HO  G     8 -11.590   2.150  -9.340
   92    H5*    C   9            HO  C     9   2.100   7.110 -12.470
   93   1H5*    C   9          H51*  C     9   1.020   8.710 -14.030
   94   2H5*    C   9          H52*  C     9   1.720   9.880 -12.910
   95    H4*    C   9           H4*  C     9  -0.590   9.290 -12.280
   96    H3*    C   9           H3*  C     9   1.730   8.840 -10.500
   97   1H2*    C   9          H21*  C     9   0.780   7.010  -9.440
   98   2H2*    C   9          H22*  C     9  -0.560   8.040  -9.000
   99    H1*    C   9           H1*  C     9  -1.850   7.320 -10.840
  100   1H4     C   9           H41  C     9  -1.840   1.000 -10.810
  101   2H4     C   9           H42  C     9  -0.190   0.910 -10.920
  102    H5     C   9            H5  C     9   1.230   2.790 -10.920
  103    H6     C   9            H6  C     9   1.310   5.280 -10.980
  104   1H5*    A  10          H51*  A    10  -2.380  10.470  -9.370
  105   2H5*    A  10          H52*  A    10  -2.300  11.700  -8.120
  106    H4*    A  10           H4*  A    10  -4.300  10.310  -7.850
  107    H3*    A  10           H3*  A    10  -2.320  10.760  -5.830
  108   1H2*    A  10          H21*  A    10  -1.880   8.520  -5.390
  109   2H2*    A  10          H22*  A    10  -3.440   8.570  -4.580
  110    H1*    A  10           H1*  A    10  -4.570   7.670  -6.440
  111    H8     A  10            H8  A    10  -0.740   7.020  -6.610
  112   1H6     A  10           H61  A    10  -1.020   2.420  -7.660
  113   2H6     A  10           H62  A    10  -2.200   1.250  -7.650
  114    H2     A  10            H2  A    10  -6.050   3.390  -6.620
  115   1H5*    T  11          H51*  T    11  -6.430   9.530  -4.260
  116   2H5*    T  11          H52*  T    11  -6.830  10.330  -2.740
  117    H4*    T  11           H4*  T    11  -7.260   7.930  -2.590
  118    H3*    T  11           H3*  T    11  -5.410   9.350  -0.840
  119   1H2*    T  11          H21*  T    11  -3.790   7.640  -0.880
  120   2H2*    T  11          H22*  T    11  -4.980   6.690  -0.020
  121    H1*    T  11           H1*  T    11  -5.780   5.680  -1.990
  122    H3     T  11            H3  T    11  -2.700   2.780  -3.600
  123   1H5M    T  11           H71  T    11   0.620   6.260  -3.140
  124   2H5M    T  11           H72  T    11  -0.100   6.630  -4.720
  125   3H5M    T  11           H73  T    11  -0.470   7.670  -3.300
  126    H6     T  11            H6  T    11  -2.500   7.450  -2.530
  127   1H5*    G  12          H51*  G    12  -8.080   5.830  -0.120
  128   2H5*    G  12          H52*  G    12  -8.830   5.730   1.470
  129    H4*    G  12           H4*  G    12  -8.350   3.500   0.530
  130    H3*    G  12           H3*  G    12  -7.630   4.390   3.140
  131   1H2*    G  12          H21*  G    12  -5.320   4.200   2.830
  132   2H2*    G  12          H22*  G    12  -5.680   2.520   3.200
  133    H1*    G  12           H1*  G    12  -5.860   1.920   0.900
  134    H8     G  12            H8  G    12  -3.640   5.080   1.440
  135    H1     G  12            H1  G    12  -0.770   0.080  -1.380
  136   1H2     G  12           H21  G    12  -2.240  -1.760  -1.170
  137   2H2     G  12           H22  G    12  -3.750  -1.570  -0.510
  138   1H5*    C  13          H51*  C    13  -7.690   0.030   1.540
  139   2H5*    C  13          H52*  C    13  -8.500  -1.000   2.720
  140    H4*    C  13           H4*  C    13  -6.820  -2.270   1.480
  141    H3*    C  13           H3*  C    13  -7.060  -2.140   4.270
  142   1H2*    C  13          H21*  C    13  -4.900  -1.160   4.680
  143   2H2*    C  13          H22*  C    13  -4.410  -2.840   4.490
  144    H1*    C  13           H1*  C    13  -3.860  -2.500   2.180
  145   1H4     C  13           H41  C    13   0.590   2.010   2.430
  146   2H4     C  13           H42  C    13  -0.370   3.050   3.310
  147    H5     C  13            H5  C    13  -2.570   2.480   4.030
  148    H6     C  13            H6  C    13  -4.330   0.770   3.980
  149   1H5*    A  14          H51*  A    14  -4.460  -5.090   1.890
  150   2H5*    A  14          H52*  A    14  -4.810  -6.710   2.450
  151    H4*    A  14           H4*  A    14  -2.540  -6.570   1.580
  152    H3*    A  14           H3*  A    14  -3.220  -7.640   4.090
  153   1H2*    A  14          H21*  A    14  -2.140  -5.900   5.370
  154   2H2*    A  14          H22*  A    14  -0.780  -6.980   5.110
  155    H1*    A  14           H1*  A    14  -0.050  -5.750   3.190
  156    H8     A  14            H8  A    14  -2.220  -3.570   5.560
  157   1H6     A  14           H61  A    14   0.600   0.230   5.330
  158   2H6     A  14           H62  A    14   2.190   0.530   4.920
  159    H2     A  14            H2  A    14   3.810  -3.390   3.350
  160   1H5*    T  15          H51*  T    15   1.210  -8.580   2.780
  161   2H5*    T  15          H52*  T    15   1.680 -10.160   3.390
  162    H4*    T  15           H4*  T    15   3.380  -8.500   3.910
  163    H3*    T  15           H3*  T    15   1.930  -9.950   6.040
  164   1H2*    T  15          H21*  T    15   2.030  -8.140   7.480
  165   2H2*    T  15          H22*  T    15   3.780  -8.320   7.410
  166    H1*    T  15           H1*  T    15   4.000  -6.740   5.670
  167    H3     T  15            H3  T    15   3.380  -2.620   7.350
  168   1H5M    T  15           H71  T    15  -0.570  -4.170   9.460
  169   2H5M    T  15           H72  T    15  -1.310  -3.820   7.880
  170   3H5M    T  15           H73  T    15  -1.030  -5.510   8.380
  171    H6     T  15            H6  T    15   0.570  -6.510   7.250
  172   1H5*    G  16          H51*  G    16   6.390  -8.980   5.890
  173   2H5*    G  16          H52*  G    16   7.430 -10.080   6.770
  174    H4*    G  16           H4*  G    16   8.070  -7.720   7.100
  175    H3*    G  16           H3*  G    16   7.700  -9.630   9.190
  176   1H2*    G  16          H21*  G    16   5.850  -8.400  10.220
  177   2H2*    G  16          H22*  G    16   7.210  -7.530  10.920
  178    H1*    G  16           H1*  G    16   7.240  -5.940   9.150
  179    H8     G  16            H8  G    16   3.700  -7.390   9.840
  180    H1     G  16            H1  G    16   4.550  -1.090  10.740
  181   1H2     G  16           H21  G    16   6.850  -0.630  10.310
  182   2H2     G  16           H22  G    16   7.870  -1.840   9.830
  183    H3*    G  16            HO  G    16   9.770  -8.370   8.780
   


Please acknowledge these references in publications where the data from this site have been utilized.

Contact the webmaster for help, if required. Friday, May 10, 2024 9:38:46 PM GMT (wattos1)