KEGG   COMPOUND: C05894Help
Entry
C05894                      Compound                               

Name
Undecaprenyl-diphospho-N-acetylmuramoyl-(N-acetylglucosamine)-L-alanyl-D-isoglutaminyl-L-lysyl-D-alanyl-D-alanine
Formula
C94H157N9O25P2
Exact mass
1874.0766
Mol weight
1875.2452
Structure
Mol fileKCF fileDB searchJmolKegDraw
Reaction
Pathway
Peptidoglycan biosynthesis
Metabolic pathways
Enzyme
2.3.2.10        2.3.2.16        6.3.5.-
Brite
Lipids [BR:br08002]
 PR  Prenol Lipids
  PR03 Polyprenols
   PR0303 Bactoprenol diphosphates
    C05894  Undecaprenyl-diphospho-N-acetylmuramoyl-(N-acetylglucosamine)-L-alanyl-D-isoglutaminyl-L-lysyl-D-alanyl-D-alanine
BRITE hierarchy
Other DBs
PubChem: 
ChEBI: 
3DMET: 
NIKKAJI: 
KCF data Show

ATOM        130
            1   C1y C    34.9300  -20.6500
            2   C1y C    33.8100  -19.9500
            3   C1y C    36.1200  -19.9500
            4   O2a O    34.9300  -24.0800
            5   C1y C    33.8100  -18.6200
            6   O2a O    31.6400  -20.1600
            7   C1y C    36.1200  -18.6200
            8   N1b N    37.3100  -20.6500
            9   C1c C    33.8100  -24.7100
            10  O2x O    35.0000  -17.9200
            11  C1b C    32.6200  -17.9200
            12  C1y C    29.8200  -21.2800
            13  O2b O    37.3100  -17.9200
            14  C5a C    37.2400  -21.9800
            15  C5a C    33.8100  -26.0400
            16  C1a C    32.6200  -24.0800
            17  O1a O    32.6200  -16.5900
            18  C1y C    29.8200  -22.6100
            19  O2x O    28.6300  -20.5800
            20  C1a C    36.0500  -22.6100
            21  O5a O    38.4300  -22.6800
            22  N1b N    32.6200  -26.7400
            23  O5a O    34.9300  -26.7400
            24  C1y C    28.6300  -23.3100
            25  N1b N    30.9400  -23.3100
            26  C1y C    27.5100  -21.2100
            27  C1c C    31.4300  -27.4400
            28  C1y C    27.5100  -22.6100
            29  O1a O    28.6300  -24.6400
            30  C5a C    32.1300  -22.6100
            31  C1b C    26.3200  -20.5800
            32  C5a C    30.3100  -26.6700
            33  C1a C    31.4300  -28.7700
            34  O1a O    26.3200  -23.2400
            35  C1a C    33.3200  -23.2400
            36  O5a O    32.1300  -21.2100
            37  O1a O    26.3200  -19.2500
            38  N1b N    29.1200  -27.3700
            39  O5a O    30.3100  -25.3400
            40  C1c C    27.9300  -26.6700
            41  C1b C    26.7400  -27.3700
            42  C5a C    27.5800  -25.3400
            43  C1b C    25.5500  -26.6700
            44  N1a N    26.1800  -25.5500
            45  O5a O    27.5800  -24.0100
            46  C5a C    24.3600  -27.3700
            47  N1b N    23.1700  -26.6700
            48  O5a O    24.3600  -28.7000
            49  C1c C    22.0500  -27.3700
            50  C5a C    20.8600  -26.6700
            51  C1b C    21.9800  -28.7000
            52  N1b N    19.6700  -27.3000
            53  O5a O    20.8600  -25.2700
            54  C1b C    20.7900  -29.4000
            55  C1c C    18.4800  -28.0000
            56  C1b C    20.7900  -30.7300
            57  C5a C    17.2900  -27.3000
            58  C1a C    18.4800  -29.3300
            59  C1b C    19.6000  -31.4300
            60  N1b N    16.1000  -28.0000
            61  O5a O    17.2900  -25.9000
            62  N1a N    19.6000  -32.7600
            63  C1c C    14.9800  -28.6300
            64  C6a C    13.7900  -27.9300
            65  C1a C    14.9800  -30.0300
            66  O6a O    12.6000  -28.6300
            67  O6a O    13.7900  -26.6000
            68  C1b C    48.4400  -14.7700
            69  C1b C    47.3900  -15.4700
            70  C2c C    46.1300  -14.7700
            71  C1a C    46.1300  -13.3700
            72  C1b C    44.9400  -16.8700
            73  C2b C    44.9400  -15.4700
            74  O2b O    43.1900  -17.9200
            75  C1a C    62.1600  -15.4700
            76  C2c C    60.9000  -14.7700
            77  C2b C    59.6400  -15.4700
            78  C1a C    60.9000  -13.3700
            79  C1b C    58.3800  -14.7700
            80  C1b C    57.1900  -15.4700
            81  C2c C    55.9300  -14.7700
            82  C2b C    54.6700  -15.4700
            83  C1a C    55.9300  -13.3700
            84  C1b C    53.4100  -14.7700
            85  C1b C    52.2200  -15.4700
            86  C2c C    50.9600  -14.7700
            87  C2b C    49.7000  -15.4700
            88  C1a C    50.9600  -13.3700
            89  P1b P    41.7200  -17.9200
            90  O2c O    40.2500  -17.9200
            91  O1c O    41.7200  -16.4500
            92  O1c O    41.7200  -19.3900
            93  P1b P    38.7800  -17.9200
            94  O1c O    38.7800  -16.4500
            95  O1c O    38.7800  -19.3900
            96  C1b C    47.3900  -15.4700
            97  C2c C    46.1300  -14.7700
            98  C1a C    46.1300  -13.3700
            99  C1b C    44.9400  -16.8700
            100 C2b C    44.9400  -15.4700
            101 C1b C    47.3900  -15.4700
            102 C2c C    46.1300  -14.7700
            103 C1a C    46.1300  -13.3700
            104 C1b C    44.9400  -16.8700
            105 C2b C    44.9400  -15.4700
            106 C1b C    47.3900  -15.4700
            107 C2c C    46.1300  -14.7700
            108 C1a C    46.1300  -13.3700
            109 C1b C    44.9400  -16.8700
            110 C2b C    44.9400  -15.4700
            111 C1b C    47.3900  -15.4700
            112 C2c C    46.1300  -14.7700
            113 C1a C    46.1300  -13.3700
            114 C1b C    44.9400  -16.8700
            115 C2b C    44.9400  -15.4700
            116 C1b C    47.3900  -15.4700
            117 C2c C    46.1300  -14.7700
            118 C1a C    46.1300  -13.3700
            119 C1b C    44.9400  -16.8700
            120 C2b C    44.9400  -15.4700
            121 C1b C    47.3900  -15.4700
            122 C2c C    46.1300  -14.7700
            123 C1a C    46.1300  -13.3700
            124 C1b C    44.9400  -16.8700
            125 C2b C    44.9400  -15.4700
            126 C1b C    47.3900  -15.4700
            127 C2c C    46.1300  -14.7700
            128 C1a C    46.1300  -13.3700
            129 C1b C    44.9400  -16.8700
            130 C2b C    44.9400  -15.4700
BOND        131
            1    46  48 2
            2    49  47 1 #Up
            3    49  50 1
            4    49  51 1
            5    50  52 1
            6    50  53 2
            7    51  54 1
            8    55  52 1 #Down
            9    54  56 1
            10   55  57 1
            11   55  58 1
            12   56  59 1
            13   57  60 1
            14   57  61 2
            15   59  62 1
            16   63  60 1 #Down
            17   63  64 1
            18   63  65 1
            19   64  66 1
            20   64  67 2
            21    7  10 1
            22   26  28 1
            23    1   2 1
            24    1   3 1
            25    1   4 1 #Up
            26    2   5 1
            27    2   6 1 #Down
            28    3   7 1
            29    3   8 1 #Down
            30    4   9 1
            31    5  10 1
            32    5  11 1 #Up
            33   12   6 1 #Up
            34    7  13 1 #Down
            35    8  14 1
            36    9  15 1
            37    9  16 1 #Up
            38   11  17 1
            39   12  18 1
            40   12  19 1
            41   14  20 1
            42   14  21 2
            43   15  22 1
            44   15  23 2
            45   18  24 1
            46   18  25 1 #Down
            47   19  26 1
            48   27  22 1 #Up
            49   24  28 1
            50   24  29 1 #Up
            51   25  30 1
            52   26  31 1 #Up
            53   27  32 1
            54   27  33 1
            55   28  34 1 #Down
            56   30  35 1
            57   30  36 2
            58   31  37 1
            59   32  38 1
            60   32  39 2
            61   40  38 1 #Down
            62   40  41 1
            63   40  42 1
            64   41  43 1
            65   42  44 1
            66   42  45 2
            67   43  46 1
            68   46  47 1
            69   79  80 1
            70   80  81 1
            71   81  82 2
            72   81  83 1
            73   82  84 1
            74   77  79 1
            75   75  76 1
            76   76  77 2
            77   84  85 1
            78   85  86 1
            79   86  87 2
            80   86  88 1
            81   87  68 1
            82   76  78 1
            83   74  89 1
            84   89  90 1
            85   89  91 1
            86   89  92 2
            87   90  93 1
            88   93  13 1
            89   93  94 1
            90   93  95 2
            91   68  69 1
            92   70  71 1
            93   70  69 1
            94   72  73 1
            95   73  70 2
            96   72  96 1
            97   97  98 1
            98   97  96 1
            99   99 100 1
            100 100  97 2
            101  99 101 1
            102 102 103 1
            103 102 101 1
            104 104 105 1
            105 105 102 2
            106 104 106 1
            107 107 108 1
            108 107 106 1
            109 109 110 1
            110 110 107 2
            111 109 111 1
            112 112 113 1
            113 112 111 1
            114 114 115 1
            115 115 112 2
            116 114 116 1
            117 117 118 1
            118 117 116 1
            119 119 120 1
            120 120 117 2
            121 119 121 1
            122 122 123 1
            123 122 121 1
            124 124 125 1
            125 125 122 2
            126 124 126 1
            127 127 128 1
            128 127 126 1
            129 129 130 1
            130 130 127 2
            131 129  74 1
BRACKET     1    44.6600  -17.9900   44.6600  -12.7400
            1    47.6000  -12.7400   47.6000  -17.9900
            1  8
 ORIGINAL  1   69  70  71  72  73
 REPEAT    1   96  97  98  99 100 101 102 103 104 105 106 107 108 109 110 111
            1  112 113 114 115 116 117 118 119 120 121 122 123 124 125 126 127
            1  128 129 130

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