data_OTP
#

_chem_comp.id                                   OTP
_chem_comp.name                                 "(2E,6E,10E,14E,18E,22E,26E)-3,7,11,15,19,23,27,31-OCTAMETHYLDOTRIACONTA-2,6,10,14,18,22,26,30-OCTAENYL TRIHYDROGEN DIPHOSPHATE"
_chem_comp.type                                 NON-POLYMER
_chem_comp.pdbx_type                            HETAIN
_chem_comp.formula                              "C40 H68 O7 P2"
_chem_comp.mon_nstd_parent_comp_id              ?
_chem_comp.pdbx_synonyms                        "OCTAPRENYL PYROPHOSPHATE"
_chem_comp.pdbx_formal_charge                   0
_chem_comp.pdbx_initial_date                    2004-12-06
_chem_comp.pdbx_modified_date                   2021-03-01
_chem_comp.pdbx_ambiguous_flag                  N
_chem_comp.pdbx_release_status                  REL
_chem_comp.pdbx_replaced_by                     ?
_chem_comp.pdbx_replaces                        ?
_chem_comp.formula_weight                       722.911
_chem_comp.one_letter_code                      ?
_chem_comp.three_letter_code                    OTP
_chem_comp.pdbx_model_coordinates_details       ?
_chem_comp.pdbx_model_coordinates_missing_flag  N
_chem_comp.pdbx_ideal_coordinates_details       ?
_chem_comp.pdbx_ideal_coordinates_missing_flag  N
_chem_comp.pdbx_model_coordinates_db_code       1WUB
_chem_comp.pdbx_subcomponent_list               ?
_chem_comp.pdbx_processing_site                 RCSB
#   #
loop_
_chem_comp_atom.comp_id
_chem_comp_atom.atom_id
_chem_comp_atom.alt_atom_id
_chem_comp_atom.type_symbol
_chem_comp_atom.charge
_chem_comp_atom.pdbx_align
_chem_comp_atom.pdbx_aromatic_flag
_chem_comp_atom.pdbx_leaving_atom_flag
_chem_comp_atom.pdbx_stereo_config
_chem_comp_atom.model_Cartn_x
_chem_comp_atom.model_Cartn_y
_chem_comp_atom.model_Cartn_z
_chem_comp_atom.pdbx_model_Cartn_x_ideal
_chem_comp_atom.pdbx_model_Cartn_y_ideal
_chem_comp_atom.pdbx_model_Cartn_z_ideal
_chem_comp_atom.pdbx_component_atom_id
_chem_comp_atom.pdbx_component_comp_id
_chem_comp_atom.pdbx_ordinal
OTP  O7    O7    O  0  1  N  N  N  -3.331  62.710  48.486  -2.416   0.398  -16.588  O7    OTP    1  
OTP  P2    P2    P  0  1  N  N  N  -3.536  63.978  49.289  -1.007   0.277  -15.818  P2    OTP    2  
OTP  O5    O5    O  0  1  N  N  N  -3.962  65.161  48.460  -0.391  -1.033  -16.122  O5    OTP    3  
OTP  O6    O6    O  0  1  N  N  N  -4.344  63.800  50.559  -0.027   1.457  -16.306  O6    OTP    4  
OTP  O4    O4    O  0  1  N  N  N  -2.022  64.359  49.740  -1.250   0.402  -14.231  O4    OTP    5  
OTP  P1    P1    P  0  1  N  N  S  -1.310  63.944  51.147   0.192   0.273  -13.529  P1    OTP    6  
OTP  O2    O2    O  0  1  N  N  N  -0.318  65.051  51.451   0.790  -1.037  -13.868  O2    OTP    7  
OTP  O3    O3    O  0  1  N  N  N  -2.383  63.686  52.172   1.153   1.453  -14.054  O3    OTP    8  
OTP  O1    O1    O  0  1  N  N  N  -0.437  62.631  50.798   0.024   0.389  -11.932  O1    OTP    9  
OTP  C40   C40   C  0  1  N  N  N   0.800  62.689  50.090   1.331   0.268  -11.369  C40   OTP   10  
OTP  C39   C39   C  0  1  N  N  N   0.772  61.651  48.966   1.243   0.369   -9.868  C39   OTP   11  
OTP  C37   C37   C  0  1  N  N  N   2.130  61.160  48.477   1.913  -0.467   -9.114  C37   OTP   12  
OTP  C38   C38   C  0  1  N  N  N   3.326  61.495  49.362   2.864  -1.453   -9.744  C38   OTP   13  
OTP  C36   C36   C  0  1  N  N  N   2.036  59.673  48.158   1.733  -0.444   -7.618  C36   OTP   14  
OTP  C35   C35   C  0  1  N  N  N   0.818  59.372  47.285   0.602  -1.396   -7.226  C35   OTP   15  
OTP  C34   C34   C  0  1  N  N  N   1.141  58.008  46.711   0.422  -1.373   -5.730  C34   OTP   16  
OTP  C32   C32   C  0  1  N  N  N   1.580  57.727  45.464  -0.747  -1.084   -5.215  C32   OTP   17  
OTP  C33   C33   C  0  1  N  N  N   1.814  58.787  44.405  -1.940  -0.892   -6.116  C33   OTP   18  
OTP  C31   C31   C  0  1  N  N  N   1.874  56.247  45.199  -0.899  -0.942   -3.722  C31   OTP   19  
OTP  C30   C30   C  0  1  N  N  N   1.796  55.698  43.806  -0.647   0.511   -3.319  C30   OTP   20  
OTP  C29   C29   C  0  1  N  N  N   1.870  54.373  43.477  -0.799   0.652   -1.827  C29   OTP   21  
OTP  C27   C27   C  0  1  N  N  N   1.743  54.058  42.165   0.171   1.168   -1.115  C27   OTP   22  
OTP  C28   C28   C  0  1  N  N  N   1.577  55.132  41.162   1.390   1.732   -1.800  C28   OTP   23  
OTP  C26   C26   C  0  1  N  N  N   1.780  52.701  41.464   0.070   1.199    0.387  C26   OTP   24  
OTP  C25   C25   C  0  1  N  N  N   2.744  51.699  41.971   0.672  -0.083    0.965  C25   OTP   25  
OTP  C24   C24   C  0  1  N  N  N   2.749  50.422  41.535   0.571  -0.052    2.468  C24   OTP   26  
OTP  C22   C22   C  0  1  N  N  N   3.630  49.598  42.131  -0.030  -1.027    3.104  C22   OTP   27  
OTP  C23   C23   C  0  1  N  N  N   4.498  50.114  43.258  -0.726  -2.116    2.329  C23   OTP   28  
OTP  C21   C21   C  0  1  N  N  N   3.721  48.113  41.798  -0.026  -1.059    4.611  C21   OTP   29  
OTP  C20   C20   C  0  1  N  N  N   4.902  47.568  41.031  -1.246  -0.303    5.140  C20   OTP   30  
OTP  C19   C19   C  0  1  N  N  N   4.919  46.227  40.808  -1.242  -0.335    6.647  C19   OTP   31  
OTP  C17   C17   C  0  1  N  N  N   5.903  45.679  40.099  -1.285   0.783    7.326  C17   OTP   32  
OTP  C18   C18   C  0  1  N  N  N   6.941  46.593  39.525  -1.455   2.096    6.605  C18   OTP   33  
OTP  C16   C16   C  0  1  N  N  N   5.983  44.189  39.778  -1.165   0.759    8.828  C16   OTP   34  
OTP  C15   C15   C  0  1  N  N  N   5.196  43.178  40.609   0.307   0.873    9.224  C15   OTP   35  
OTP  C14   C14   C  0  1  N  N  N   5.574  41.865  40.440   0.428   0.849   10.726  C14   OTP   36  
OTP  C12   C12   C  0  1  N  N  N   5.086  40.807  41.130   1.209  -0.027   11.306  C12   OTP   37  
OTP  C13   C13   C  0  1  N  N  N   4.007  41.062  42.148   2.077  -0.933   10.470  C13   OTP   38  
OTP  C11   C11   C  0  1  N  N  N   5.544  39.351  40.958   1.241  -0.130   12.809  C11   OTP   39  
OTP  C10   C10   C  0  1  N  N  N   6.933  39.143  41.585   0.191  -1.140   13.274  C10   OTP   40  
OTP  C9    C9    C  0  1  N  N  N   7.606  37.971  41.328   0.223  -1.243   14.777  C9    OTP   41  
OTP  C7    C7    C  0  1  N  N  N   8.868  37.642  41.689  -0.872  -1.054   15.470  C7    OTP   42  
OTP  C8    C8    C  0  1  N  N  N   9.769  38.550  42.450  -2.186  -0.854   14.761  C8    OTP   43  
OTP  C6    C6    C  0  1  N  N  N   9.535  36.312  41.303  -0.817  -1.036   16.976  C6    OTP   44  
OTP  C5    C5    C  0  1  N  N  N   9.407  35.143  42.220  -0.569   0.392   17.460  C5    OTP   45  
OTP  C4    C4    C  0  1  N  N  N  10.037  33.963  41.962  -0.514   0.410   18.966  C4    OTP   46  
OTP  C2    C2    C  0  1  N  N  N   9.836  32.882  42.735   0.526   0.919   19.578  C2    OTP   47  
OTP  C3    C3    C  0  1  N  N  N   8.943  32.907  43.947   0.636   0.828   21.078  C3    OTP   48  
OTP  C1    C1    C  0  1  N  N  N  10.523  31.611  42.368   1.612   1.594   18.782  C1    OTP   49  
OTP  HO7   HO7   H  0  1  N  N  N  -3.062  61.964  49.009  -2.227   0.319  -17.532  HO7   OTP   50  
OTP  HO6   HO6   H  0  1  N  N  N  -4.473  64.595  51.063  -0.465   2.292  -16.090  HO6   OTP   51  
OTP  HO3   HO3   H  0  1  N  N  N  -1.968  63.444  52.992   0.727   2.287  -13.814  HO3   OTP   52  
OTP  H401  1H40  H  0  0  N  N  N   1.682  62.567  50.761   1.967   1.067  -11.750  H401  OTP   53  
OTP  H402  2H40  H  0  0  N  N  N   1.031  63.714  49.718   1.757  -0.697  -11.643  H402  OTP   54  
OTP  H39   H39   H  0  1  N  N  N  -0.172  61.279  48.534   0.628   1.131   -9.413  H39   OTP   55  
OTP  H381  1H38  H  0  0  N  N  N   3.143  61.127  50.399   3.583  -0.918  -10.365  H381  OTP   56  
OTP  H382  2H38  H  0  0  N  N  N   4.319  61.136  49.004   3.393  -1.997   -8.962  H382  OTP   57  
OTP  H383  3H38  H  0  0  N  N  N   3.365  62.595  49.542   2.303  -2.155  -10.360  H383  OTP   58  
OTP  H361  1H36  H  0  0  N  N  N   2.039  59.054  49.085   1.484   0.567   -7.298  H361  OTP   59  
OTP  H362  2H36  H  0  0  N  N  N   2.976  59.293  47.695   2.658  -0.761   -7.136  H362  OTP   60  
OTP  H351  1H35  H  0  0  N  N  N   0.585  60.154  46.525   0.851  -2.408   -7.546  H351  OTP   61  
OTP  H352  2H35  H  0  0  N  N  N  -0.161  59.435  47.814  -0.322  -1.080   -7.708  H352  OTP   62  
OTP  H34   H34   H  0  1  N  N  N   1.041  57.075  47.291   1.257  -1.595   -5.082  H34   OTP   63  
OTP  H331  1H33  H  0  0  N  N  N   2.510  59.542  44.840  -2.065  -1.773   -6.745  H331  OTP   64  
OTP  H332  2H33  H  0  0  N  N  N   2.176  58.555  43.376  -2.833  -0.748   -5.509  H332  OTP   65  
OTP  H333  3H33  H  0  0  N  N  N   0.867  59.366  44.301  -1.783  -0.016   -6.745  H333  OTP   66  
OTP  H311  1H31  H  0  0  N  N  N   1.212  55.635  45.855  -0.178  -1.588   -3.221  H311  OTP   67  
OTP  H312  2H31  H  0  0  N  N  N   2.882  56.010  45.614  -1.909  -1.231   -3.431  H312  OTP   68  
OTP  H301  1H30  H  0  0  N  N  N   2.582  56.220  43.212  -1.368   1.157   -3.821  H301  OTP   69  
OTP  H302  2H30  H  0  0  N  N  N   0.850  56.086  43.362   0.362   0.799   -3.611  H302  OTP   70  
OTP  H29   H29   H  0  1  N  N  N   2.026  53.591  44.239  -1.709   0.328   -1.344  H29   OTP   71  
OTP  H281  1H28  H  0  0  N  N  N   2.421  55.852  41.272   1.082   2.481   -2.530  H281  OTP   72  
OTP  H282  2H28  H  0  0  N  N  N   1.473  54.873  40.083   2.042   2.193   -1.059  H282  OTP   73  
OTP  H283  3H28  H  0  0  N  N  N   0.707  55.762  41.460   1.926   0.929   -2.307  H283  OTP   74  
OTP  H261  1H26  H  0  0  N  N  N   1.946  52.854  40.372  -0.977   1.272    0.679  H261  OTP   75  
OTP  H262  2H26  H  0  0  N  N  N   0.756  52.259  41.460   0.615   2.061    0.771  H262  OTP   76  
OTP  H251  1H25  H  0  0  N  N  N   2.657  51.677  43.082   1.720  -0.156    0.673  H251  OTP   77  
OTP  H252  2H25  H  0  0  N  N  N   3.770  52.111  41.824   0.127  -0.945    0.581  H252  OTP   78  
OTP  H24   H24   H  0  1  N  N  N   2.072  50.072  40.738   0.995   0.772    3.021  H24   OTP   79  
OTP  H231  1H23  H  0  0  N  N  N   3.837  50.552  44.042   0.008  -2.678    1.753  H231  OTP   80  
OTP  H232  2H23  H  0  0  N  N  N   5.228  49.431  43.752  -1.235  -2.786    3.021  H232  OTP   81  
OTP  H233  3H23  H  0  0  N  N  N   5.045  51.017  42.899  -1.455  -1.671    1.652  H233  OTP   82  
OTP  H211  1H21  H  0  0  N  N  N   2.790  47.819  41.260   0.883  -0.586    4.982  H211  OTP   83  
OTP  H212  2H21  H  0  0  N  N  N   3.626  47.536  42.748  -0.063  -2.093    4.952  H212  OTP   84  
OTP  H201  1H20  H  0  0  N  N  N   5.849  47.876  41.534  -2.155  -0.776    4.769  H201  OTP   85  
OTP  H202  2H20  H  0  0  N  N  N   5.000  48.110  40.061  -1.209   0.731    4.799  H202  OTP   86  
OTP  H19   H19   H  0  1  N  N  N   4.124  45.575  41.208  -1.204  -1.281    7.167  H19   OTP   87  
OTP  H181  1H18  H  0  0  N  N  N   7.378  47.212  40.343  -2.418   2.108    6.094  H181  OTP   88  
OTP  H182  2H18  H  0  0  N  N  N   7.765  46.134  38.931  -1.415   2.914    7.325  H182  OTP   89  
OTP  H183  3H18  H  0  0  N  N  N   6.440  47.378  38.912  -0.655   2.215    5.875  H183  OTP   90  
OTP  H161  1H16  H  0  0  N  N  N   7.056  43.887  39.782  -1.572  -0.177    9.209  H161  OTP   91  
OTP  H162  2H16  H  0  0  N  N  N   5.714  44.047  38.705  -1.721   1.595    9.251  H162  OTP   92  
OTP  H151  1H15  H  0  0  N  N  N   4.103  43.291  40.419   0.714   1.810    8.842  H151  OTP   93  
OTP  H152  2H15  H  0  0  N  N  N   5.235  43.454  41.689   0.864   0.037    8.801  H152  OTP   94  
OTP  H14   H14   H  0  1  N  N  N   6.341  41.639  39.680  -0.130   1.553   11.324  H14   OTP   95  
OTP  H131  1H13  H  0  0  N  N  N   3.162  41.599  41.657   2.791  -0.333    9.906  H131  OTP   96  
OTP  H132  2H13  H  0  0  N  N  N   3.605  40.191  42.716   2.615  -1.622   11.120  H132  OTP   97  
OTP  H133  3H13  H  0  0  N  N  N   4.361  41.836  42.869   1.452  -1.498    9.779  H133  OTP   98  
OTP  H111  1H11  H  0  0  N  N  N   5.520  39.033  39.890   1.025   0.845   13.244  H111  OTP   99  
OTP  H112  2H11  H  0  0  N  N  N   4.795  38.631  41.363   2.230  -0.459   13.130  H112  OTP  100  
OTP  H101  1H10  H  0  0  N  N  N   6.855  39.279  42.689   0.408  -2.116   12.838  H101  OTP  101  
OTP  H102  2H10  H  0  0  N  N  N   7.587  40.003  41.307  -0.796  -0.811   12.953  H102  OTP  102  
OTP  H9    H9    H  0  1  N  N  N   7.065  37.196  40.760   1.149  -1.472   15.283  H9    OTP  103  
OTP  H81   1H8   H  0  1  N  N  N   9.228  38.850  43.378  -2.365  -1.690   14.084  H81   OTP  104  
OTP  H82   2H8   H  0  1  N  N  N  10.809  38.279  42.748  -2.991  -0.803   15.495  H82   OTP  105  
OTP  H83   3H8   H  0  1  N  N  N   9.827  39.509  41.883  -2.155   0.073   14.191  H83   OTP  106  
OTP  H61   1H6   H  0  1  N  N  N  10.617  36.497  41.108  -0.008  -1.682   17.317  H61   OTP  107  
OTP  H62   2H6   H  0  1  N  N  N   9.178  36.013  40.290  -1.764  -1.397   17.378  H62   OTP  108  
OTP  H51   1H5   H  0  1  N  N  N   8.321  34.930  42.354  -1.378   1.038   17.118  H51   OTP  109  
OTP  H52   2H5   H  0  1  N  N  N   9.705  35.475  43.242   0.377   0.753   17.058  H52   OTP  110  
OTP  H4    H4    H  0  1  N  N  N  10.727  33.881  41.106  -1.333   0.004   19.541  H4    OTP  111  
OTP  H31   1H3   H  0  1  N  N  N   7.943  33.278  43.621   1.562   1.302   21.403  H31   OTP  112  
OTP  H32   2H3   H  0  1  N  N  N   8.776  32.010  44.588  -0.211   1.335   21.537  H32   OTP  113  
OTP  H33   3H3   H  0  1  N  N  N   9.297  33.732  44.608   0.640  -0.219   21.379  H33   OTP  114  
OTP  H11   1H1   H  0  1  N  N  N  11.619  31.801  42.287   1.176   2.381   18.166  H11   OTP  115  
OTP  H12   2H1   H  0  1  N  N  N  10.356  30.714  43.009   2.344   2.030   19.462  H12   OTP  116  
OTP  H13   3H1   H  0  1  N  N  N  10.272  31.354  41.312   2.102   0.861   18.141  H13   OTP  117  
#   #
loop_
_chem_comp_bond.comp_id
_chem_comp_bond.atom_id_1
_chem_comp_bond.atom_id_2
_chem_comp_bond.value_order
_chem_comp_bond.pdbx_aromatic_flag
_chem_comp_bond.pdbx_stereo_config
_chem_comp_bond.pdbx_ordinal
OTP  O7   P2    SING  N  N    1  
OTP  O7   HO7   SING  N  N    2  
OTP  P2   O5    DOUB  N  N    3  
OTP  P2   O6    SING  N  N    4  
OTP  P2   O4    SING  N  N    5  
OTP  O6   HO6   SING  N  N    6  
OTP  O4   P1    SING  N  N    7  
OTP  P1   O2    DOUB  N  N    8  
OTP  P1   O3    SING  N  N    9  
OTP  P1   O1    SING  N  N   10  
OTP  O3   HO3   SING  N  N   11  
OTP  O1   C40   SING  N  N   12  
OTP  C40  C39   SING  N  N   13  
OTP  C40  H401  SING  N  N   14  
OTP  C40  H402  SING  N  N   15  
OTP  C39  C37   DOUB  N  E   16  
OTP  C39  H39   SING  N  N   17  
OTP  C37  C38   SING  N  N   18  
OTP  C37  C36   SING  N  N   19  
OTP  C38  H381  SING  N  N   20  
OTP  C38  H382  SING  N  N   21  
OTP  C38  H383  SING  N  N   22  
OTP  C36  C35   SING  N  N   23  
OTP  C36  H361  SING  N  N   24  
OTP  C36  H362  SING  N  N   25  
OTP  C35  C34   SING  N  N   26  
OTP  C35  H351  SING  N  N   27  
OTP  C35  H352  SING  N  N   28  
OTP  C34  C32   DOUB  N  E   29  
OTP  C34  H34   SING  N  N   30  
OTP  C32  C33   SING  N  N   31  
OTP  C32  C31   SING  N  N   32  
OTP  C33  H331  SING  N  N   33  
OTP  C33  H332  SING  N  N   34  
OTP  C33  H333  SING  N  N   35  
OTP  C31  C30   SING  N  N   36  
OTP  C31  H311  SING  N  N   37  
OTP  C31  H312  SING  N  N   38  
OTP  C30  C29   SING  N  N   39  
OTP  C30  H301  SING  N  N   40  
OTP  C30  H302  SING  N  N   41  
OTP  C29  C27   DOUB  N  E   42  
OTP  C29  H29   SING  N  N   43  
OTP  C27  C28   SING  N  N   44  
OTP  C27  C26   SING  N  N   45  
OTP  C28  H281  SING  N  N   46  
OTP  C28  H282  SING  N  N   47  
OTP  C28  H283  SING  N  N   48  
OTP  C26  C25   SING  N  N   49  
OTP  C26  H261  SING  N  N   50  
OTP  C26  H262  SING  N  N   51  
OTP  C25  C24   SING  N  N   52  
OTP  C25  H251  SING  N  N   53  
OTP  C25  H252  SING  N  N   54  
OTP  C24  C22   DOUB  N  E   55  
OTP  C24  H24   SING  N  N   56  
OTP  C22  C23   SING  N  N   57  
OTP  C22  C21   SING  N  N   58  
OTP  C23  H231  SING  N  N   59  
OTP  C23  H232  SING  N  N   60  
OTP  C23  H233  SING  N  N   61  
OTP  C21  C20   SING  N  N   62  
OTP  C21  H211  SING  N  N   63  
OTP  C21  H212  SING  N  N   64  
OTP  C20  C19   SING  N  N   65  
OTP  C20  H201  SING  N  N   66  
OTP  C20  H202  SING  N  N   67  
OTP  C19  C17   DOUB  N  E   68  
OTP  C19  H19   SING  N  N   69  
OTP  C17  C18   SING  N  N   70  
OTP  C17  C16   SING  N  N   71  
OTP  C18  H181  SING  N  N   72  
OTP  C18  H182  SING  N  N   73  
OTP  C18  H183  SING  N  N   74  
OTP  C16  C15   SING  N  N   75  
OTP  C16  H161  SING  N  N   76  
OTP  C16  H162  SING  N  N   77  
OTP  C15  C14   SING  N  N   78  
OTP  C15  H151  SING  N  N   79  
OTP  C15  H152  SING  N  N   80  
OTP  C14  C12   DOUB  N  E   81  
OTP  C14  H14   SING  N  N   82  
OTP  C12  C13   SING  N  N   83  
OTP  C12  C11   SING  N  N   84  
OTP  C13  H131  SING  N  N   85  
OTP  C13  H132  SING  N  N   86  
OTP  C13  H133  SING  N  N   87  
OTP  C11  C10   SING  N  N   88  
OTP  C11  H111  SING  N  N   89  
OTP  C11  H112  SING  N  N   90  
OTP  C10  C9    SING  N  N   91  
OTP  C10  H101  SING  N  N   92  
OTP  C10  H102  SING  N  N   93  
OTP  C9   C7    DOUB  N  E   94  
OTP  C9   H9    SING  N  N   95  
OTP  C7   C8    SING  N  N   96  
OTP  C7   C6    SING  N  N   97  
OTP  C8   H81   SING  N  N   98  
OTP  C8   H82   SING  N  N   99  
OTP  C8   H83   SING  N  N  100  
OTP  C6   C5    SING  N  N  101  
OTP  C6   H61   SING  N  N  102  
OTP  C6   H62   SING  N  N  103  
OTP  C5   C4    SING  N  N  104  
OTP  C5   H51   SING  N  N  105  
OTP  C5   H52   SING  N  N  106  
OTP  C4   C2    DOUB  N  N  107  
OTP  C4   H4    SING  N  N  108  
OTP  C2   C3    SING  N  N  109  
OTP  C2   C1    SING  N  N  110  
OTP  C3   H31   SING  N  N  111  
OTP  C3   H32   SING  N  N  112  
OTP  C3   H33   SING  N  N  113  
OTP  C1   H11   SING  N  N  114  
OTP  C1   H12   SING  N  N  115  
OTP  C1   H13   SING  N  N  116  
#   #
loop_
_pdbx_chem_comp_descriptor.comp_id
_pdbx_chem_comp_descriptor.type
_pdbx_chem_comp_descriptor.program
_pdbx_chem_comp_descriptor.program_version
_pdbx_chem_comp_descriptor.descriptor
OTP  SMILES            ACDLabs               10.04  "O=P(O)(O)OP(=O)(O)OC/C=C(/CC\C=C(/C)CC\C=C(/C)CC\C=C(/C)CC\C=C(/C)CC\C=C(/C)CC\C=C(/C)CC\C=C(/C)C)C"  
OTP  SMILES_CANONICAL  CACTVS                3.341  "CC(C)=CCCC(/C)=C/CCC(/C)=C/CCC(/C)=C/CCC(/C)=C/CCC(/C)=C/CCC(/C)=C/CCC(/C)=C/CO[P@@](O)(=O)O[P](O)(O)=O"  
OTP  SMILES            CACTVS                3.341  "CC(C)=CCCC(C)=CCCC(C)=CCCC(C)=CCCC(C)=CCCC(C)=CCCC(C)=CCCC(C)=CCO[P](O)(=O)O[P](O)(O)=O"  
OTP  SMILES_CANONICAL  "OpenEye OEToolkits"  1.5.0  "CC(=CCC/C(=C/CC/C(=C/CC/C(=C/CC/C(=C/CC/C(=C/CC/C(=C/CC/C(=C/CO[P@](=O)(O)OP(=O)(O)O)/C)/C)/C)/C)/C)/C)/C)C"  
OTP  SMILES            "OpenEye OEToolkits"  1.5.0  "CC(=CCCC(=CCCC(=CCCC(=CCCC(=CCCC(=CCCC(=CCCC(=CCOP(=O)(O)OP(=O)(O)O)C)C)C)C)C)C)C)C"  
OTP  InChI             InChI                 1.03   "InChI=1S/C40H68O7P2/c1-33(2)17-10-18-34(3)19-11-20-35(4)21-12-22-36(5)23-13-24-37(6)25-14-26-38(7)27-15-28-39(8)29-16-30-40(9)31-32-46-49(44,45)47-48(41,42)43/h17,19,21,23,25,27,29,31H,10-16,18,20,22,24,26,28,30,32H2,1-9H3,(H,44,45)(H2,41,42,43)/b34-19+,35-21+,36-23+,37-25+,38-27+,39-29+,40-31+"  
OTP  InChIKey          InChI                 1.03   IKKLDISSULFFQO-DJMILUHSSA-N  
#   #
loop_
_pdbx_chem_comp_identifier.comp_id
_pdbx_chem_comp_identifier.type
_pdbx_chem_comp_identifier.program
_pdbx_chem_comp_identifier.program_version
_pdbx_chem_comp_identifier.identifier
OTP  "SYSTEMATIC NAME"  ACDLabs               10.04  "(2E,6E,10E,14E,18E,22E,26E)-3,7,11,15,19,23,27,31-octamethyldotriaconta-2,6,10,14,18,22,26,30-octaen-1-yl trihydrogen diphosphate"  
OTP  "SYSTEMATIC NAME"  "OpenEye OEToolkits"  1.5.0  "[(2E,6E,10E,14E,18E,22E,26E)-3,7,11,15,19,23,27,31-octamethyldotriaconta-2,6,10,14,18,22,26,30-octaenyl] phosphono hydrogen phosphate"  
#   #
loop_
_pdbx_chem_comp_audit.comp_id
_pdbx_chem_comp_audit.action_type
_pdbx_chem_comp_audit.date
_pdbx_chem_comp_audit.processing_site
OTP  "Create component"   2004-12-06  RCSB  
OTP  "Modify descriptor"  2011-06-04  RCSB  
OTP  "Modify synonyms"    2021-03-01  PDBE  
#
_pdbx_chem_comp_synonyms.ordinal     1
_pdbx_chem_comp_synonyms.comp_id     OTP
_pdbx_chem_comp_synonyms.name        "OCTAPRENYL PYROPHOSPHATE"
_pdbx_chem_comp_synonyms.provenance  ?
_pdbx_chem_comp_synonyms.type        ?
##
