KEGG   RPAIR: RP03642Help
Entry
RP03642                     RPair                                  

Name
C02686_C06128
Compound
C02686  
Galactosylceramide
C06128  
GM4
Type
main
RDM
1
1     O1a-O2a:*-C1z:C1y-C1y
RClass
Related pair
Reaction
Enzyme
KCF data Show

ALIGN       35
            1     1:C1y  29:C1y
            2     2:O2x  33:O2x
            3     3:O2a   1:O2a
            4     4:C1y  27:C1y
            5     5:C1y  31:C1y
            6     6:C1b   2:C1b
            7     7:C1y  26:C1y #M1
            8     8:O1a  30:O1a
            9     9:C1y  28:C1y
            10   10:C1b  34:C1b
            11   11:C1c   3:C1c
            12   12:O1a  25:O2a #R1
            13   13:O1a  32:O1a
            14   14:O1a  35:O1a
            15   15:C1c   4:C1c
            16   16:N1b   5:N1b
            17   17:C2b   6:C2b
            18   18:O1a   7:O1a
            19   19:C5a   8:C5a
            20   20:C2b   9:C2b
            21   21:O5a  10:O5a
            22   22:R    11:R
            23   23:C1b  12:C1b
            24   24:C1b  13:C1b
            25   25:C1b  14:C1b
            26   26:C1b  15:C1b
            27   27:C1b  16:C1b
            28   28:C1b  17:C1b
            29   29:C1b  18:C1b
            30   30:C1b  19:C1b
            31   31:C1b  20:C1b
            32   32:C1b  21:C1b
            33   33:C1b  22:C1b
            34   34:C1b  23:C1b
            35   35:C1a  24:C1a
            -       *    36:C1z #D1
ENTRY1      
 COMPOUND  C02686
 ATOM      35
            1   C1y C    16.5901  -16.0713
            2   O2x O    15.3381  -15.3480
            3   O2a O    18.0309  -15.4085
            4   C1y C    16.5843  -17.4993
            5   C1y C    14.1045  -16.0713
            6   C1b C    19.2470  -16.1016
            7   C1y C    15.3381  -18.2225
            8   O1a O    17.8365  -18.2225
            9   C1y C    14.1045  -17.4993
            10  C1b C    12.8769  -15.3480
            11  C1c C    20.4256  -15.4085
            12  O1a O    15.3322  -19.6506
            13  O1a O    12.8639  -18.2225
            14  O1a O    11.7762  -16.2775
            15  C1c C    21.6230  -16.1016
            16  N1b N    20.4256  -14.0410
            17  C2b C    22.8146  -15.4085
            18  O1a O    21.6230  -17.4748
            19  C5a C    21.6045  -13.3597
            20  C2b C    24.0063  -16.1016
            21  O5a O    21.6045  -11.9922
            22  R   R    22.7900  -14.0410
            23  C1b C    25.1907  -15.4085
            24  C1b C    26.3764  -16.1016
            25  C1b C    27.5738  -15.4085
            26  C1b C    28.7654  -16.1016
            27  C1b C    29.9500  -15.4085
            28  C1b C    31.1355  -16.1016
            29  C1b C    32.3331  -15.4085
            30  C1b C    33.5117  -16.1016
            31  C1b C    34.7034  -15.4085
            32  C1b C    35.9135  -16.1016
            33  C1b C    37.0922  -15.4085
            34  C1b C    38.2896  -16.1016
            35  C1a C    39.4625  -15.4085
 BOND      35
            1     1   2 1
            2     1   3 1 #Up
            3     1   4 1
            4     2   5 1
            5     3   6 1
            6     4   7 1
            7     4   8 1 #Down
            8     5   9 1
            9     5  10 1 #Up
            10    6  11 1
            11    7  12 1 #Up
            12    9  13 1 #Up
            13   10  14 1
            14   11  15 1
            15   11  16 1 #Down
            16   15  17 1
            17   15  18 1 #Up
            18   16  19 1
            19   17  20 2
            20   19  21 2
            21   19  22 1
            22   20  23 1
            23   23  24 1
            24   24  25 1
            25   25  26 1
            26   26  27 1
            27   27  28 1
            28   28  29 1
            29   29  30 1
            30   30  31 1
            31   31  32 1
            32   32  33 1
            33   33  34 1
            34   34  35 1
            35    7   9 1
ENTRY2      
 COMPOUND  C06128
 ATOM      55
            1   O2a O    18.1790  -20.3279
            2   C1b C    19.3900  -21.0265
            3   C1c C    20.5542  -20.2813
            4   C1c C    21.7652  -20.9799
            5   N1b N    20.5542  -18.9307
            6   C2b C    22.9760  -20.2813
            7   O1a O    21.8117  -22.4237
            8   C5a C    21.7186  -18.1855
            9   C2b C    24.1869  -20.9799
            10  O5a O    21.7186  -16.8350
            11  R   R    22.9294  -18.8841
            12  C1b C    25.3978  -20.2348
            13  C1b C    26.6087  -20.9334
            14  C1b C    27.8195  -20.2348
            15  C1b C    29.0305  -20.8868
            16  C1b C    30.2413  -20.1882
            17  C1b C    31.4522  -20.8868
            18  C1b C    32.6631  -20.1882
            19  C1b C    33.8740  -20.8402
            20  C1b C    35.0848  -20.1416
            21  C1b C    36.2958  -20.8402
            22  C1b C    37.5066  -20.1416
            23  C1b C    38.7175  -20.7936
            24  C1a C    39.9284  -20.0951
            25  O2a O    15.7107  -24.4263
            26  C1y C    15.7573  -23.0291
            27  C1y C    16.9682  -22.3770
            28  C1y C    14.5464  -22.3305
            29  C1y C    16.9682  -21.0265
            30  O1a O    17.9462  -22.8894
            31  C1y C    14.5464  -20.9334
            32  O1a O    13.3355  -23.3556
            33  O2x O    15.8038  -20.2813
            34  C1b C    13.3821  -20.2348
            35  O1a O    12.2178  -20.9334
            36  C1z C    14.0341  -25.3577
            37  O2x O    12.8698  -24.6591
            38  C1x C    14.0341  -26.7549
            39  C6a C    15.2450  -25.9632
            40  C1y C    11.6589  -25.3577
            41  C1y C    12.8698  -27.4535
            42  O6a O    16.4093  -25.2646
            43  O6a O    15.2450  -27.4069
            44  C1y C    11.6589  -26.7549
            45  O1a O    12.8698  -28.8040
            46  C1c C    10.4481  -24.6125
            47  C1c C    10.4481  -23.2153
            48  C1b C     9.1906  -22.4703
            49  O1a O     9.1906  -21.0265
            50  O1a O     9.1906  -25.3577
            51  O1a O    11.6589  -22.4703
            52  N1b N    10.4481  -27.4535
            53  C5a C    10.4481  -28.8973
            54  C1a C     9.1906  -29.5958
            55  O5a O    11.6589  -29.5958
 BOND      56
            1     1   2 1
            2     2   3 1
            3     3   4 1
            4     3   5 1 #Down
            5     4   6 1
            6     4   7 1 #Up
            7     5   8 1
            8     6   9 2
            9     8  10 2
            10    8  11 1
            11    9  12 1
            12   12  13 1
            13   13  14 1
            14   14  15 1
            15   15  16 1
            16   16  17 1
            17   17  18 1
            18   18  19 1
            19   19  20 1
            20   20  21 1
            21   21  22 1
            22   22  23 1
            23   23  24 1
            24   26  25 1 #Up
            25   26  27 1
            26   26  28 1
            27   27  29 1
            28   27  30 1 #Down
            29   28  31 1
            30   28  32 1 #Up
            31   29   1 1 #Up
            32   29  33 1
            33   31  34 1 #Up
            34   34  35 1
            35   31  33 1
            36   36  37 1
            37   36  25 1 #Down
            38   36  38 1
            39   36  39 1 #Up
            40   37  40 1
            41   38  41 1
            42   39  42 1
            43   39  43 2
            44   40  44 1
            45   41  45 1 #Down
            46   41  44 1
            47   40  46 1
            48   46  47 1
            49   47  48 1
            50   48  49 1
            51   46  50 1 #Down
            52   47  51 1 #Up
            53   44  52 1 #Up
            54   52  53 1
            55   53  54 1
            56   53  55 2

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