KEGG   COMPOUND: C13741
Entry
C13741                      Compound                               
Name
beta,gamma-Methylene ATP;
AMP-PCP
Formula
C11H18N5O12P3
Exact mass
505.0165
Mol weight
505.2082
Structure
Other DBs
PubChem: 586330
ChEBI: 40532
PDB-CCD: ACP[PDBj]
NIKKAJI: J152.173J
KCF data

ATOM        31
            1   N4y N    23.4510  -15.3996
            2   C8y C    24.5068  -16.1346
            3   C1y C    22.1679  -15.8139
            4   C8x C    23.9293  -14.0056
            5   C8y C    25.7373  -15.2304
            6   N5x N    24.6466  -17.5520
            7   O2x O    21.0307  -14.9624
            8   C1y C    21.7363  -17.0621
            9   N5x N    25.3760  -13.9415
            10  C8y C    26.9916  -15.7788
            11  C8x C    25.9650  -18.1410
            12  C1y C    19.9222  -15.7554
            13  C1y C    20.3542  -17.0621
            14  O1a O    22.5411  -18.1993
            15  N5x N    27.1549  -17.2603
            16  N1a N    28.0997  -14.9564
            17  C1b C    18.6041  -15.3297
            18  O1a O    19.9105  -18.3802
            19  O2b O    17.5718  -16.2629
            20  P1b P    16.1721  -16.2629
            21  O1c O    16.1662  -17.6569
            22  O1c O    16.1662  -14.8687
            23  O2c O    14.7721  -16.2635
            24  P1b P    13.3684  -16.2969
            25  O1c O    13.3627  -17.6911
            26  O1c O    13.3627  -14.8971
            27  C1b C    12.1576  -15.6100
            28  P1b P    10.9451  -16.3100
            29  O1c O    10.9451  -14.9100
            30  O1c O    10.9451  -17.7100
            31  O1c O     9.5451  -16.3100
BOND        33
            1     5  10 1
            2     6  11 2
            3     7  12 1
            4     8  13 1
            5     8  14 1 #Down
            6    10  15 2
            7    10  16 1
            8    12  17 1 #Up
            9    13  18 1 #Down
            10   17  19 1
            11   19  20 1
            12   20  21 1
            13   20  22 2
            14    5   9 1
            15   11  15 1
            16   12  13 1
            17   20  23 1
            18    1   2 1
            19    3   1 1 #Up
            20    1   4 1
            21    2   5 2
            22    2   6 1
            23    3   7 1
            24    3   8 1
            25    4   9 2
            26   24  25 1
            27   24  26 2
            28   23  24 1
            29   24  27 1
            30   27  28 1
            31   28  29 2
            32   28  30 1
            33   28  31 1

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