KEGG   COMPOUND: C04339Help
Entry
C04339                      Compound                               

Name
Peptide N-(ADP-D-ribosyl)diphthamide;
EF-2 N-(ADP-D-ribosyl)diphthamide;
Elongation factor 2 N-(ADP-D-ribosyl)diphthamide
Formula
C29H44N11O16P2R2
Structure
Mol fileKCF fileDB searchJmolKegDraw
Comment
Generic compound in reaction hierarchy
Elongation factor 2 inactivated by diphtheria toxin
Reaction
Enzyme
Other DBs
PubChem: 
KCF data Show

ATOM        60
            1   C8y C    26.0400  -20.0900
            2   C1b C    24.8500  -19.3900
            3   C8x C    26.0400  -21.3500
            4   N5x N    28.2100  -20.0900
            5   C1c C    23.6600  -20.0900
            6   N4y N    27.1600  -21.9800
            7   C8y C    28.2100  -21.3500
            8   C5a C    22.4700  -19.3900
            9   N1b N    23.6600  -21.4900
            10  N1b N    21.2800  -20.0900
            11  O5a O    22.4700  -17.9900
            12  C1b C    29.4000  -22.0500
            13  C1b C    30.5900  -21.3500
            14  C1c C    31.8500  -21.9800
            15  C5a C    33.0400  -21.3500
            16  N1d N    31.8500  -23.3800 #+
            17  N1a N    34.2300  -21.9800
            18  O5a O    33.0400  -19.9500
            19  C5a C    22.4000  -22.1900
            20  O5a O    21.2100  -21.4900
            21  R   R    22.4000  -23.5900
            22  R   R    20.0900  -19.3900
            23  C1a C    30.5900  -24.0800
            24  C1a C    33.0400  -24.0800
            25  C1a C    31.8500  -24.7800
            26  C1y C    27.1600  -23.8000
            27  C1y C    25.8300  -24.2200
            28  C1y C    25.8300  -25.6200
            29  C1y C    27.1600  -26.0400
            30  O2x O    28.0000  -24.9200
            31  O1a O    24.6400  -23.5200
            32  O1a O    24.6400  -26.3200
            33  C1b C    27.5100  -27.3700
            34  O2b O    28.9100  -27.3700
            35  P1b P    30.3100  -27.3700
            36  O2c O    31.7100  -27.3700
            37  P1b P    33.1100  -27.3700
            38  O1c O    30.3100  -25.9700
            39  O1c O    33.1100  -25.9700
            40  O1c O    30.3100  -28.7700
            41  O1c O    33.1100  -28.7700
            42  O2b O    34.5100  -27.3700
            43  C1b C    35.9100  -27.3700
            44  C1y C    37.1000  -28.0700
            45  C1y C    37.5200  -29.4000
            46  C1y C    38.9200  -29.4000
            47  C1y C    39.3400  -28.0700
            48  O2x O    38.2200  -27.2300
            49  O1a O    36.8200  -30.6124
            50  O1a O    39.6200  -30.6124
            51  N5x N    36.7500  -24.0100
            52  C8x C    36.7500  -25.4100
            53  N5x N    37.9624  -26.1100
            54  C8y C    39.1749  -25.4100
            55  C8y C    39.1749  -24.0100
            56  C8y C    37.9624  -23.3100
            57  N4y N    40.5064  -25.8426
            58  C8x C    41.3293  -24.7100
            59  N5x N    40.5064  -23.5774
            60  N1a N    37.9624  -21.9100
BOND        64
            1     5   8 1
            2     5   9 1 #Down
            3     8  10 1
            4     8  11 2
            5     6   7 1
            6     7  12 1
            7     1   2 1
            8    12  13 1
            9     1   3 2
            10   13  14 1
            11    1   4 1
            12   14  15 1
            13    2   5 1
            14   14  16 1 #Up
            15    3   6 1
            16   15  17 1
            17    4   7 2
            18   15  18 2
            19    9  19 1
            20   19  20 2
            21   19  21 1
            22   10  22 1
            23   16  23 1
            24   16  24 1
            25   16  25 1
            26   26   6 1 #Up
            27   27  28 1
            28   28  29 1
            29   29  30 1
            30   30  26 1
            31   27  26 1
            32   27  31 1 #Up
            33   28  32 1 #Up
            34   29  33 1 #Down
            35   33  34 1
            36   34  35 1
            37   35  36 1
            38   36  37 1
            39   35  38 2
            40   37  39 2
            41   35  40 1
            42   37  41 1
            43   37  42 1
            44   42  43 1
            45   44  43 1 #Up
            46   45  46 1
            47   46  47 1
            48   47  48 1
            49   48  44 1
            50   45  44 1
            51   45  49 1 #Down
            52   46  50 1 #Down
            53   51  52 2
            54   52  53 1
            55   53  54 2
            56   54  55 1
            57   55  56 2
            58   51  56 1
            59   54  57 1
            60   57  58 1
            61   58  59 2
            62   55  59 1
            63   56  60 1
            64   47  57 1 #Up

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