data_EIW
# 
_chem_comp.id                                    EIW 
_chem_comp.name                                  "(2~{R},4~{R},5~{R},6~{R})-6-[(1~{R})-1,2-bis(oxidanyl)ethyl]-4-[(2~{R},3~{S},4~{S},5~{R},6~{R})-6-[(1~{S})-1,2-bis(oxidanyl)ethyl]-4-[(2~{R},3~{S},4~{S},5~{S},6~{R})-6-[(1~{S})-1,2-bis(oxidanyl)ethyl]-3,4,5-tris(oxidanyl)oxan-2-yl]oxy-3,5-bis(oxidanyl)oxan-2-yl]oxy-2-[[(2~{R},3~{S},4~{R},5~{R},6~{R})-4-[(3~{R})-3-nonanoyloxytetradecanoyl]oxy-5-[[(3~{R})-3-octanoyloxytetradecanoyl]amino]-6-[[(2~{R},3~{S},4~{S},5~{S},6~{R})-3-oxidanyl-5-[[(3~{R})-3-oxidanylnonanoyl]amino]-4-[(3~{R})-3-oxidanyltetradecanoyl]oxy-6-phosphonooxy-oxan-2-yl]methoxy]-3-phosphonooxy-oxan-2-yl]methoxy]-5-oxidanyl-oxane-2-carboxylic acid" 
_chem_comp.type                                  non-polymer 
_chem_comp.pdbx_type                             HETAIN 
_chem_comp.formula                               "C102 H186 N2 O44 P2" 
_chem_comp.mon_nstd_parent_comp_id               ? 
_chem_comp.pdbx_synonyms                         ? 
_chem_comp.pdbx_formal_charge                    0 
_chem_comp.pdbx_initial_date                     2022-01-07 
_chem_comp.pdbx_modified_date                    2022-08-22 
_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                        2206.503 
_chem_comp.one_letter_code                       ? 
_chem_comp.three_letter_code                     EIW 
_chem_comp.pdbx_model_coordinates_details        ? 
_chem_comp.pdbx_model_coordinates_missing_flag   N 
_chem_comp.pdbx_ideal_coordinates_details        Corina 
_chem_comp.pdbx_ideal_coordinates_missing_flag   N 
_chem_comp.pdbx_model_coordinates_db_code        7PH2 
_chem_comp.pdbx_subcomponent_list                ? 
_chem_comp.pdbx_processing_site                  PDBE 
# 
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 
EIW CAL  C1   C 0 1 N N N 139.278 134.612 147.732 -5.658  0.438   7.625   CAL  EIW 1   
EIW CAP  C2   C 0 1 N N N 141.652 134.610 150.125 -5.985  -1.384  11.000  CAP  EIW 2   
EIW CAR  C3   C 0 1 N N N 142.353 136.615 151.658 -5.711  -2.276  13.317  CAR  EIW 3   
EIW CAT  C4   C 0 1 N N N 143.012 138.781 153.032 -5.437  -3.168  15.635  CAT  EIW 4   
EIW CBA  C5   C 0 1 N N N 140.004 132.035 154.300 -11.824 6.724   -5.509  CBA  EIW 5   
EIW CBB  C6   C 0 1 N N N 140.050 131.581 155.784 -12.189 8.128   -5.994  CBB  EIW 6   
EIW CBC  C7   C 0 1 N N N 141.289 132.105 156.524 -12.867 8.035   -7.363  CBC  EIW 7   
EIW CBE  C8   C 0 1 N N N 141.855 132.929 158.900 -13.910 9.346   -9.217  CBE  EIW 8   
EIW CBG  C9   C 0 1 N N N 143.723 133.171 160.607 -14.952 10.657  -11.070 CBG  EIW 9   
EIW CBI  C10  C 0 1 N N R 134.617 132.776 136.155 5.342   4.397   0.730   CBI  EIW 10  
EIW CBK  C11  C 0 1 N N S 134.319 132.786 133.678 7.603   3.586   0.049   CBK  EIW 11  
EIW CBM  C12  C 0 1 N N R 136.358 131.708 134.735 6.157   2.342   1.659   CBM  EIW 12  
EIW CBV  C13  C 0 1 N N R 133.885 135.218 132.628 9.175   4.210   -1.649  CBV  EIW 13  
EIW CBX  C14  C 0 1 N N S 132.189 136.312 134.095 11.177  5.608   -1.128  CBX  EIW 14  
EIW CBZ  C15  C 0 1 N N R 131.494 134.647 132.342 8.884   6.571   -1.342  CBZ  EIW 15  
EIW CCB  C16  C 0 1 N N N 130.497 132.839 130.928 6.578   7.454   -1.724  CCB  EIW 16  
EIW OAZ  O1   O 0 1 N N N 137.339 134.583 146.334 -7.255  -0.591  6.226   OAZ  EIW 17  
EIW OBH  O2   O 0 1 N N N 138.136 131.316 148.009 -7.656  3.994   1.805   OBH  EIW 18  
EIW OBS  O3   O 0 1 N N N 136.090 132.648 135.833 5.416   3.544   1.874   OBS  EIW 19  
EIW OBU  O4   O 0 1 N N N 139.951 131.193 135.587 4.689   0.290   4.440   OBU  EIW 20  
EIW OB1  O5   O 0 1 N N N 136.580 130.481 146.467 -7.293  1.815   1.852   OB1  EIW 21  
EIW CB2  C17  C 0 1 N N N 137.176 130.635 147.823 -7.811  2.915   1.284   CB2  EIW 22  
EIW CB3  C18  C 0 1 N N N 136.542 129.862 149.042 -8.585  2.805   -0.004  CB3  EIW 23  
EIW C02  C19  C 0 1 N N S 135.267 131.511 144.727 -5.081  2.247   2.780   C02  EIW 24  
EIW C03  C20  C 0 1 N N R 135.503 132.098 143.338 -4.497  1.015   2.084   C03  EIW 25  
EIW C04  C21  C 0 1 N N N 134.150 132.548 142.717 -3.005  1.234   1.824   C04  EIW 26  
EIW C06  C22  C 0 1 N N R 132.435 133.567 144.144 -1.063  0.133   0.952   C06  EIW 27  
EIW C07  C23  C 0 1 N N R 132.273 134.582 145.280 -0.629  -1.014  0.036   C07  EIW 28  
EIW C09  C24  C 0 1 N N N 133.459 133.831 147.546 -1.913  -3.085  -0.001  C09  EIW 29  
EIW C10  C25  C 0 1 N N N 133.409 132.927 148.806 -2.441  -4.320  0.681   C10  EIW 30  
EIW C11  C26  C 0 1 N N R 134.292 133.421 149.935 -3.068  -5.250  -0.360  C11  EIW 31  
EIW C13  C27  C 0 1 N N N 134.743 131.938 151.859 -4.311  -4.758  -2.333  C13  EIW 32  
EIW C14  C28  C 0 1 N N N 135.738 132.304 153.002 -5.486  -4.159  -3.062  C14  EIW 33  
EIW C15  C29  C 0 1 N N N 135.427 131.576 154.326 -5.445  -4.582  -4.531  C15  EIW 34  
EIW C16  C30  C 0 1 N N N 135.258 132.583 155.479 -6.701  -4.076  -5.243  C16  EIW 35  
EIW C17  C31  C 0 1 N N N 136.407 132.522 156.492 -6.660  -4.499  -6.713  C17  EIW 36  
EIW C18  C32  C 0 1 N N N 136.595 133.862 157.206 -7.916  -3.994  -7.425  C18  EIW 37  
EIW C19  C33  C 0 1 N N N 136.069 133.847 158.674 -7.875  -4.417  -8.894  C19  EIW 38  
EIW C20  C34  C 0 1 N N N 137.149 134.343 159.683 -9.132  -3.912  -9.606  C20  EIW 39  
EIW C26  C35  C 0 1 N N N 133.370 134.072 150.971 -3.582  -6.515  0.330   C26  EIW 40  
EIW C27  C36  C 0 1 N N N 133.274 135.626 150.752 -4.095  -7.498  -0.725  C27  EIW 41  
EIW C28  C37  C 0 1 N N N 132.052 136.221 151.528 -4.609  -8.764  -0.035  C28  EIW 42  
EIW C29  C38  C 0 1 N N N 132.489 136.973 152.809 -5.123  -9.746  -1.089  C29  EIW 43  
EIW C30  C39  C 0 1 N N N 133.901 136.560 153.277 -5.636  -11.012 -0.400  C30  EIW 44  
EIW C31  C40  C 0 1 N N N 133.933 136.242 154.772 -6.150  -11.994 -1.454  C31  EIW 45  
EIW C32  C41  C 0 1 N N N 132.541 135.955 155.335 -6.663  -13.260 -0.765  C32  EIW 46  
EIW C33  C42  C 0 1 N N N 132.489 136.151 156.878 -7.177  -14.242 -1.819  C33  EIW 47  
EIW C34  C43  C 0 1 N N N 131.408 135.196 157.495 -7.691  -15.508 -1.130  C34  EIW 48  
EIW C35  C44  C 0 1 N N N 132.009 134.115 158.463 -8.205  -16.490 -2.184  C35  EIW 49  
EIW C36  C45  C 0 1 N N N 130.890 133.373 159.264 -8.718  -17.756 -1.495  C36  EIW 50  
EIW C39  C46  C 0 1 N N R 130.743 134.759 142.775 0.793   1.486   0.262   C39  EIW 51  
EIW C40  C47  C 0 1 N N N 131.599 135.387 141.639 1.145   2.860   -0.312  C40  EIW 52  
EIW C42  C48  C 0 1 N N R 132.459 134.489 139.338 0.937   5.209   0.119   C42  EIW 53  
EIW C43  C49  C 0 1 N N N 131.158 134.797 138.700 0.200   5.411   -1.179  C43  EIW 54  
EIW C46  C50  C 0 1 N N N 132.983 133.196 138.690 2.435   5.426   -0.105  C46  EIW 55  
EIW C47  C51  C 0 1 N N R 134.329 133.348 138.051 3.170   5.278   1.231   C47  EIW 56  
EIW C64  C52  C 0 1 N N R 135.285 134.025 138.946 2.583   6.272   2.237   C64  EIW 57  
EIW C66  C53  C 0 1 N N R 134.791 135.410 139.404 1.079   6.023   2.371   C66  EIW 58  
EIW C67  C54  C 0 1 N N R 135.599 136.466 138.703 0.474   7.051   3.329   C67  EIW 59  
EIW C69  C55  C 0 1 N N N 134.691 137.641 138.288 -1.029  6.801   3.463   C69  EIW 60  
EIW C72  C56  C 0 1 N N S 130.518 135.739 143.935 1.301   0.393   -0.682  C72  EIW 61  
EIW C78  C57  C 0 1 N N R 131.001 135.298 145.258 0.893   -0.976  -0.131  C78  EIW 62  
EIW C80  C58  C 0 1 N N N 130.397 136.657 147.328 2.524   -2.547  -0.873  C80  EIW 63  
EIW C81  C59  C 0 1 N N N 129.770 135.286 148.026 2.999   -3.669  -1.761  C81  EIW 64  
EIW C82  C60  C 0 1 N N R 128.273 135.443 148.572 4.416   -4.077  -1.353  C82  EIW 65  
EIW C84  C61  C 0 1 N N N 128.320 136.720 150.580 6.403   -2.873  -0.825  C84  EIW 66  
EIW C85  C62  C 0 1 N N N 127.559 136.948 151.877 7.436   -1.808  -1.091  C85  EIW 67  
EIW C86  C63  C 0 1 N N N 128.490 137.289 153.094 8.621   -1.997  -0.142  C86  EIW 68  
EIW C87  C64  C 0 1 N N N 128.369 136.210 154.258 9.714   -0.981  -0.481  C87  EIW 69  
EIW C88  C65  C 0 1 N N N 126.890 136.085 154.794 10.939  -1.238  0.398   C88  EIW 70  
EIW C89  C66  C 0 1 N N N 126.782 135.257 156.151 12.032  -0.222  0.060   C89  EIW 71  
EIW C90  C67  C 0 1 N N N 126.957 136.168 157.423 13.258  -0.480  0.938   C90  EIW 72  
EIW C91  C68  C 0 1 N N N 125.887 135.842 158.539 14.350  0.536   0.600   C91  EIW 73  
EIW C92  C69  C 0 1 N N N 125.906 134.349 158.952 15.576  0.279   1.478   C92  EIW 74  
EIW C99  C70  C 0 1 N N N 127.459 134.219 148.059 4.841   -5.311  -2.151  C99  EIW 75  
EIW CA0  C71  C 0 1 N N N 126.004 134.162 148.627 6.206   -5.794  -1.656  CA0  EIW 76  
EIW CA1  C72  C 0 1 N N N 125.786 132.961 149.573 6.631   -7.028  -2.454  CA1  EIW 77  
EIW CA2  C73  C 0 1 N N N 125.565 133.408 150.984 7.996   -7.511  -1.959  CA2  EIW 78  
EIW CA3  C74  C 0 1 N N N 125.532 132.269 151.981 8.421   -8.745  -2.757  CA3  EIW 79  
EIW CA4  C75  C 0 1 N N N 124.828 131.026 151.444 9.785   -9.228  -2.262  CA4  EIW 80  
EIW CA5  C76  C 0 1 N N N 125.182 129.746 152.254 10.210  -10.462 -3.060  CA5  EIW 81  
EIW CA6  C77  C 0 1 N N N 125.227 128.512 151.364 11.575  -10.944 -2.565  CA6  EIW 82  
EIW CA7  C78  C 0 1 N N N 124.687 127.265 152.064 12.000  -12.179 -3.363  CA7  EIW 83  
EIW CA8  C79  C 0 1 N N N 124.155 126.223 151.072 13.365  -12.661 -2.868  CA8  EIW 84  
EIW CA9  C80  C 0 1 N N N 123.778 124.915 151.755 13.790  -13.895 -3.666  CA9  EIW 85  
EIW CAC  C81  C 0 1 N N R 137.769 132.809 143.773 -6.036  -0.442  3.207   CAC  EIW 86  
EIW CAI  C82  C 0 1 N N S 137.747 131.963 145.056 -6.681  0.732   3.948   CAI  EIW 87  
EIW CAK  C83  C 0 1 N N N 138.310 133.985 146.667 -6.361  0.225   6.310   CAK  EIW 88  
EIW CAM  C84  C 0 1 N N R 140.562 133.776 147.939 -6.258  -0.491  8.682   CAM  EIW 89  
EIW CAO  C85  C 0 1 N N N 141.659 134.676 148.552 -5.464  -0.366  9.983   CAO  EIW 90  
EIW CAQ  C86  C 0 1 N N N 142.871 135.419 150.768 -5.190  -1.258  12.301  CAQ  EIW 91  
EIW CAS  C87  C 0 1 N N N 143.537 137.444 152.321 -4.916  -2.150  14.619  CAS  EIW 92  
EIW CB0  C88  C 0 1 N N S 136.432 131.718 145.675 -6.559  1.996   3.092   CB0  EIW 93  
EIW CB4  C89  C 0 1 N N R 137.637 129.057 149.762 -9.061  4.194   -0.433  CB4  EIW 94  
EIW CB6  C90  C 0 1 N N N 138.163 129.861 150.967 -9.739  4.101   -1.802  CB6  EIW 95  
EIW CB7  C91  C 0 1 N N N 139.725 130.054 150.925 -10.104 5.506   -2.287  CB7  EIW 96  
EIW CB8  C92  C 0 1 N N N 140.201 131.127 151.936 -10.782 5.412   -3.656  CB8  EIW 97  
EIW CB9  C93  C 0 1 N N N 139.655 130.875 153.347 -11.147 6.817   -4.141  CB9  EIW 98  
EIW CBD  C94  C 0 1 N N N 141.177 131.830 158.050 -13.232 9.439   -7.848  CBD  EIW 99  
EIW CBF  C95  C 0 1 N N N 142.547 132.320 160.126 -14.275 10.750  -9.701  CBF  EIW 100 
EIW N08  N1   N 0 1 N N N 132.321 133.766 146.542 -1.025  -2.293  0.631   N08  EIW 101 
EIW NAJ  N2   N 0 1 N N N 138.630 132.629 146.083 -5.997  0.939   5.227   NAJ  EIW 102 
EIW O01  O6   O 0 1 N N N 134.970 130.110 144.615 -4.960  3.384   1.922   O01  EIW 103 
EIW O05  O7   O 0 1 N N N 133.658 133.801 143.444 -2.487  0.138   1.067   O05  EIW 104 
EIW O12  O8   O 0 1 N N N 135.026 132.351 150.500 -4.174  -4.571  -1.011  O12  EIW 105 
EIW O25  O9   O 0 1 N N N 133.778 131.303 152.129 -3.491  -5.407  -2.939  O25  EIW 106 
EIW O37  O10  O 0 1 N N N 134.383 134.559 147.381 -2.288  -2.803  -1.120  O37  EIW 107 
EIW O38  O11  O 0 1 N N N 131.315 133.483 143.197 -0.625  1.375   0.397   O38  EIW 108 
EIW O41  O12  O 0 1 N N N 132.240 134.237 140.798 0.713   3.879   0.592   O41  EIW 109 
EIW O44  O13  O 0 1 N N N 130.852 135.984 138.450 0.356   6.552   -1.869  O44  EIW 110 
EIW O45  O14  O 0 1 N N N 130.367 133.867 138.404 -0.532  4.546   -1.600  O45  EIW 111 
EIW O48  O15  O 0 1 N N N 134.188 134.127 136.777 4.561   5.551   1.045   O48  EIW 112 
EIW O65  O16  O 0 1 N N N 136.547 134.175 138.260 2.807   7.606   1.776   O65  EIW 113 
EIW O68  O17  O 0 1 N N N 136.606 136.933 139.570 1.093   6.928   4.611   O68  EIW 114 
EIW O70  O18  O 0 1 N N N 134.044 137.295 137.082 -1.614  7.830   4.264   O70  EIW 115 
EIW O71  O19  O 0 1 N N N 133.342 135.652 139.127 0.461   6.145   1.088   O71  EIW 116 
EIW O73  O20  O 0 1 N N N 129.103 135.894 144.086 2.726   0.466   -0.773  O73  EIW 117 
EIW O75  O21  O 0 1 N N N 127.791 138.123 143.980 3.146   2.193   -2.711  O75  EIW 118 
EIW O76  O22  O 0 1 N N N 127.079 136.256 142.545 5.090   0.613   -1.913  O76  EIW 119 
EIW O77  O23  O 0 1 N N N 129.140 137.476 142.031 3.087   -0.291  -3.154  O77  EIW 120 
EIW O79  O24  O 0 1 N N N 131.215 136.560 146.099 1.306   -2.015  -1.058  O79  EIW 121 
EIW O83  O25  O 0 1 N N N 128.237 135.441 149.919 5.332   -2.985  -1.626  O83  EIW 122 
EIW O98  O26  O 0 1 N N N 128.972 137.601 150.129 6.539   -3.625  0.111   O98  EIW 123 
EIW OAA  O27  O 0 1 N N N 130.208 137.712 147.805 3.241   -2.126  0.004   OAA  EIW 124 
EIW OAB  O28  O 0 1 N N N 136.402 133.257 143.391 -4.671  -0.130  2.921   OAB  EIW 125 
EIW OAD  O29  O 0 1 N N N 138.290 132.076 142.763 -6.737  -0.678  1.985   OAD  EIW 126 
EIW OAF  O30  O 0 1 N N N 140.676 132.295 143.726 -7.906  -2.044  0.067   OAF  EIW 127 
EIW OAG  O31  O 0 1 N N N 139.695 130.034 143.589 -5.620  -2.873  1.067   OAG  EIW 128 
EIW OAH  O32  O 0 1 N N N 140.384 131.216 141.548 -7.750  -2.949  2.418   OAH  EIW 129 
EIW OAN  O33  O 0 1 N N N 140.303 132.736 148.807 -7.620  -0.127  8.918   OAN  EIW 130 
EIW OB5  O34  O 0 1 N N N 137.087 127.865 150.192 -9.994  4.695   0.527   OB5  EIW 131 
EIW P74  P1   P 0 1 N N N 128.261 136.962 143.139 3.503   0.723   -2.159  P74  EIW 132 
EIW PAE  P2   P 0 1 N N N 139.783 131.388 142.919 -7.019  -2.153  1.406   PAE  EIW 133 
EIW CBJ  C96  C 0 1 N N S 133.715 132.403 134.972 6.754   4.831   0.327   CBJ  EIW 134 
EIW CBL  C97  C 0 1 N N R 135.660 132.136 133.434 7.602   2.693   1.294   CBL  EIW 135 
EIW CBN  C98  C 0 1 N N S 137.838 131.624 134.486 6.144   1.499   2.936   CBN  EIW 136 
EIW CBO  C99  C 0 1 N N N 138.575 131.219 135.811 4.698   1.179   3.321   CBO  EIW 137 
EIW OBP  O35  O 0 1 N N N 132.445 133.071 135.118 7.343   5.584   1.389   OBP  EIW 138 
EIW OBQ  O36  O 0 1 N N N 134.493 134.243 133.652 8.942   3.980   -0.258  OBQ  EIW 139 
EIW OBR  O37  O 0 1 N N N 135.477 130.987 132.602 8.331   1.495   1.022   OBR  EIW 140 
EIW OBT  O38  O 0 1 N N N 138.313 132.858 134.043 6.769   2.227   3.994   OBT  EIW 141 
EIW CBW  C100 C 0 1 N N S 133.494 136.470 133.422 10.677  4.378   -1.893  CBW  EIW 142 
EIW CBY  C101 C 0 1 N N S 131.106 135.908 133.127 10.374  6.834   -1.575  CBY  EIW 143 
EIW CCA  C102 C 0 1 N N S 130.444 134.361 131.309 8.071   7.767   -1.841  CCA  EIW 144 
EIW OCC  O39  O 0 1 N N N 133.417 137.591 132.518 10.917  4.556   -3.291  OCC  EIW 145 
EIW OCD  O40  O 0 1 N N N 131.815 137.585 134.723 12.562  5.815   -1.410  OCD  EIW 146 
EIW OCE  O41  O 0 1 N N N 129.901 135.652 133.854 10.782  7.974   -0.815  OCE  EIW 147 
EIW OCF  O42  O 0 1 N N N 132.795 134.791 131.674 8.492   5.397   -2.057  OCF  EIW 148 
EIW OCG  O43  O 0 1 N N N 130.687 135.135 130.176 8.397   8.029   -3.207  OCG  EIW 149 
EIW OCH  O44  O 0 1 N N N 131.183 132.685 129.725 5.819   8.611   -2.079  OCH  EIW 150 
EIW H1   H1   H 0 1 N N N 139.565 135.620 147.396 -4.596  0.218   7.510   H1   EIW 151 
EIW H2   H2   H 0 1 N N N 138.746 134.683 148.692 -5.782  1.474   7.940   H2   EIW 152 
EIW H3   H3   H 0 1 N N N 140.708 135.039 150.493 -7.039  -1.192  11.198  H3   EIW 153 
EIW H4   H4   H 0 1 N N N 141.722 133.557 150.436 -5.867  -2.390  10.598  H4   EIW 154 
EIW H5   H5   H 0 1 N N N 141.760 137.292 151.026 -6.766  -2.084  13.516  H5   EIW 155 
EIW H6   H6   H 0 1 N N N 141.717 136.209 152.458 -5.594  -3.282  12.916  H6   EIW 156 
EIW H7   H7   H 0 1 N N N 143.863 139.320 153.475 -4.871  -3.078  16.562  H7   EIW 157 
EIW H8   H8   H 0 1 N N N 142.519 139.423 152.287 -6.492  -2.976  15.833  H8   EIW 158 
EIW H9   H9   H 0 1 N N N 142.293 138.518 153.822 -5.320  -4.174  15.234  H9   EIW 159 
EIW H10  H10  H 0 1 N N N 140.989 132.438 154.022 -12.729 6.121   -5.427  H10  EIW 160 
EIW H11  H11  H 0 1 N N N 139.243 132.822 154.194 -11.142 6.259   -6.221  H11  EIW 161 
EIW H12  H12  H 0 1 N N N 139.150 131.955 156.295 -12.872 8.592   -5.282  H12  EIW 162 
EIW H13  H13  H 0 1 N N N 140.060 130.481 155.816 -11.285 8.731   -6.077  H13  EIW 163 
EIW H14  H14  H 0 1 N N N 142.184 131.600 156.131 -12.185 7.570   -8.075  H14  EIW 164 
EIW H15  H15  H 0 1 N N N 141.377 133.189 156.358 -13.771 7.432   -7.280  H15  EIW 165 
EIW H16  H16  H 0 1 N N N 142.604 133.450 158.285 -13.227 8.882   -9.929  H16  EIW 166 
EIW H17  H17  H 0 1 N N N 141.092 133.647 159.236 -14.814 8.743   -9.134  H17  EIW 167 
EIW H18  H18  H 0 1 N N N 144.186 132.696 161.485 -14.270 10.193  -11.782 H18  EIW 168 
EIW H19  H19  H 0 1 N N N 144.467 133.256 159.802 -15.857 10.055  -10.988 H19  EIW 169 
EIW H20  H20  H 0 1 N N N 143.362 134.173 160.881 -15.212 11.658  -11.416 H20  EIW 170 
EIW H21  H21  H 0 1 N N N 134.414 132.021 136.929 4.878   3.858   -0.096  H21  EIW 171 
EIW H22  H22  H 0 1 N N N 133.637 132.492 132.866 7.182   3.038   -0.793  H22  EIW 172 
EIW H23  H23  H 0 1 N N N 135.989 130.710 135.014 5.704   1.776   0.845   H23  EIW 173 
EIW H24  H24  H 0 1 N N N 134.727 135.530 131.992 8.806   3.362   -2.225  H24  EIW 174 
EIW H25  H25  H 0 1 N N N 132.276 135.537 134.871 11.041  5.451   -0.058  H25  EIW 175 
EIW H26  H26  H 0 1 N N N 131.540 133.802 133.045 8.702   6.426   -0.278  H26  EIW 176 
EIW H27  H27  H 0 1 N N N 129.473 132.453 130.818 6.325   6.633   -2.395  H27  EIW 177 
EIW H28  H28  H 0 1 N N N 131.017 132.281 131.721 6.346   7.168   -0.698  H28  EIW 178 
EIW H29  H29  H 0 1 N N N 140.398 130.948 136.389 3.807   -0.016  4.692   H29  EIW 179 
EIW H30  H30  H 0 1 N N N 136.097 130.584 149.743 -7.943  2.386   -0.780  H30  EIW 180 
EIW H31  H31  H 0 1 N N N 135.763 129.177 148.677 -9.447  2.155   0.144   H31  EIW 181 
EIW H32  H32  H 0 1 N N N 134.393 132.022 145.157 -4.539  2.432   3.708   H32  EIW 182 
EIW H33  H33  H 0 1 N N N 135.940 131.321 142.694 -5.012  0.854   1.137   H33  EIW 183 
EIW H34  H34  H 0 1 N N N 134.291 132.773 141.650 -2.867  2.159   1.264   H34  EIW 184 
EIW H35  H35  H 0 1 N N N 133.408 131.743 142.827 -2.476  1.302   2.774   H35  EIW 185 
EIW H36  H36  H 0 1 N N N 132.518 132.582 144.626 -0.619  -0.002  1.938   H36  EIW 186 
EIW H37  H37  H 0 1 N N N 133.114 135.291 145.261 -1.106  -0.903  -0.938  H37  EIW 187 
EIW H38  H38  H 0 1 N N N 132.371 132.888 149.167 -1.622  -4.836  1.182   H38  EIW 188 
EIW H39  H39  H 0 1 N N N 133.737 131.916 148.523 -3.195  -4.036  1.415   H39  EIW 189 
EIW H40  H40  H 0 1 N N N 134.977 134.187 149.542 -2.319  -5.520  -1.104  H40  EIW 190 
EIW H41  H41  H 0 1 N N N 136.755 132.032 152.682 -6.412  -4.511  -2.608  H41  EIW 191 
EIW H42  H42  H 0 1 N N N 135.687 133.389 153.178 -5.439  -3.072  -2.995  H42  EIW 192 
EIW H43  H43  H 0 1 N N N 134.497 131.001 154.211 -4.561  -4.156  -5.007  H43  EIW 193 
EIW H44  H44  H 0 1 N N N 136.255 130.891 154.564 -5.403  -5.669  -4.596  H44  EIW 194 
EIW H45  H45  H 0 1 N N N 135.215 133.598 155.056 -7.584  -4.503  -4.767  H45  EIW 195 
EIW H46  H46  H 0 1 N N N 134.316 132.364 156.002 -6.743  -2.989  -5.179  H46  EIW 196 
EIW H47  H47  H 0 1 N N N 136.184 131.747 157.240 -5.777  -4.073  -7.189  H47  EIW 197 
EIW H48  H48  H 0 1 N N N 137.337 132.265 155.963 -6.618  -5.587  -6.777  H48  EIW 198 
EIW H49  H49  H 0 1 N N N 137.668 134.105 157.220 -8.800  -4.420  -6.949  H49  EIW 199 
EIW H50  H50  H 0 1 N N N 136.051 134.637 156.646 -7.958  -2.907  -7.361  H50  EIW 200 
EIW H51  H51  H 0 1 N N N 135.189 134.504 158.743 -6.992  -3.991  -9.370  H51  EIW 201 
EIW H52  H52  H 0 1 N N N 135.781 132.819 158.938 -7.833  -5.504  -8.959  H52  EIW 202 
EIW H53  H53  H 0 1 N N N 136.738 134.317 160.703 -9.102  -4.213  -10.653 H53  EIW 203 
EIW H54  H54  H 0 1 N N N 138.032 133.689 159.626 -10.015 -4.338  -9.130  H54  EIW 204 
EIW H55  H55  H 0 1 N N N 137.440 135.374 159.431 -9.173  -2.825  -9.542  H55  EIW 205 
EIW H56  H56  H 0 1 N N N 132.365 133.635 150.881 -2.770  -6.977  0.892   H56  EIW 206 
EIW H57  H57  H 0 1 N N N 133.767 133.876 151.978 -4.393  -6.255  1.010   H57  EIW 207 
EIW H58  H58  H 0 1 N N N 134.198 136.099 151.116 -4.907  -7.036  -1.287  H58  EIW 208 
EIW H59  H59  H 0 1 N N N 133.155 135.832 149.678 -3.284  -7.758  -1.405  H59  EIW 209 
EIW H60  H60  H 0 1 N N N 131.520 136.922 150.869 -3.797  -9.226  0.527   H60  EIW 210 
EIW H61  H61  H 0 1 N N N 131.377 135.400 151.811 -5.420  -8.503  0.645   H61  EIW 211 
EIW H62  H62  H 0 1 N N N 132.486 138.054 152.603 -5.934  -9.284  -1.652  H62  EIW 212 
EIW H63  H63  H 0 1 N N N 131.771 136.751 153.612 -4.312  -10.006 -1.770  H63  EIW 213 
EIW H64  H64  H 0 1 N N N 134.215 135.667 152.716 -4.825  -11.474 0.162   H64  EIW 214 
EIW H65  H65  H 0 1 N N N 134.599 137.385 153.073 -6.447  -10.751 0.280   H65  EIW 215 
EIW H66  H66  H 0 1 N N N 134.568 135.358 154.932 -6.961  -11.532 -2.017  H66  EIW 216 
EIW H67  H67  H 0 1 N N N 134.360 137.103 155.307 -5.339  -12.254 -2.134  H67  EIW 217 
EIW H68  H68  H 0 1 N N N 131.819 136.639 154.865 -5.852  -13.722 -0.203  H68  EIW 218 
EIW H69  H69  H 0 1 N N N 132.269 134.916 155.099 -7.475  -12.999 -0.085  H69  EIW 219 
EIW H70  H70  H 0 1 N N N 133.473 135.917 157.310 -7.989  -13.780 -2.382  H70  EIW 220 
EIW H71  H71  H 0 1 N N N 132.228 137.195 157.106 -6.366  -14.502 -2.499  H71  EIW 221 
EIW H72  H72  H 0 1 N N N 130.686 135.805 158.058 -6.879  -15.970 -0.567  H72  EIW 222 
EIW H73  H73  H 0 1 N N N 130.890 134.679 156.674 -8.502  -15.248 -0.450  H73  EIW 223 
EIW H74  H74  H 0 1 N N N 132.572 133.379 157.870 -9.016  -16.028 -2.746  H74  EIW 224 
EIW H75  H75  H 0 1 N N N 132.688 134.610 159.173 -7.393  -16.751 -2.864  H75  EIW 225 
EIW H76  H76  H 0 1 N N N 131.348 132.626 159.929 -9.084  -18.456 -2.246  H76  EIW 226 
EIW H77  H77  H 0 1 N N N 130.325 134.101 159.865 -7.907  -18.218 -0.932  H77  EIW 227 
EIW H78  H78  H 0 1 N N N 130.209 132.870 158.562 -9.529  -17.496 -0.814  H78  EIW 228 
EIW H79  H79  H 0 1 N N N 129.754 134.551 142.341 1.262   1.369   1.239   H79  EIW 229 
EIW H80  H80  H 0 1 N N N 132.392 136.012 142.076 2.224   2.931   -0.450  H80  EIW 230 
EIW H81  H81  H 0 1 N N N 130.959 136.005 140.993 0.646   2.991   -1.272  H81  EIW 231 
EIW H82  H82  H 0 1 N N N 132.266 132.878 137.919 2.809   4.684   -0.810  H82  EIW 232 
EIW H83  H83  H 0 1 N N N 133.053 132.421 139.467 2.603   6.426   -0.505  H83  EIW 233 
EIW H84  H84  H 0 1 N N N 134.716 132.348 137.808 3.044   4.262   1.606   H84  EIW 234 
EIW H85  H85  H 0 1 N N N 135.432 133.404 139.842 3.063   6.136   3.207   H85  EIW 235 
EIW H86  H86  H 0 1 N N N 134.964 135.496 140.487 0.910   5.019   2.761   H86  EIW 236 
EIW H87  H87  H 0 1 N N N 136.046 136.032 137.796 0.642   8.054   2.939   H87  EIW 237 
EIW H88  H88  H 0 1 N N N 135.298 138.546 138.138 -1.488  6.806   2.474   H88  EIW 238 
EIW H89  H89  H 0 1 N N N 133.942 137.828 139.072 -1.196  5.833   3.935   H89  EIW 239 
EIW H90  H90  H 0 1 N N N 130.980 136.704 143.678 0.865   0.534   -1.671  H90  EIW 240 
EIW H91  H91  H 0 1 N N N 130.226 134.684 145.740 1.370   -1.138  0.836   H91  EIW 241 
EIW H92  H92  H 0 1 N N N 129.779 134.483 147.274 2.330   -4.523  -1.656  H92  EIW 242 
EIW H93  H93  H 0 1 N N N 130.416 135.005 148.871 3.002   -3.335  -2.799  H93  EIW 243 
EIW H94  H94  H 0 1 N N N 127.843 136.362 148.148 4.435   -4.309  -0.288  H94  EIW 244 
EIW H95  H95  H 0 1 N N N 126.859 137.784 151.728 7.781   -1.887  -2.122  H95  EIW 245 
EIW H96  H96  H 0 1 N N N 126.994 136.035 152.115 6.995   -0.825  -0.930  H96  EIW 246 
EIW H97  H97  H 0 1 N N N 129.533 137.320 152.746 8.290   -1.847  0.886   H97  EIW 247 
EIW H98  H98  H 0 1 N N N 128.207 138.274 153.492 9.017   -3.007  -0.252  H98  EIW 248 
EIW H99  H99  H 0 1 N N N 128.691 135.232 153.871 9.991   -1.082  -1.530  H99  EIW 249 
EIW H100 H100 H 0 0 N N N 129.024 136.509 155.089 9.341   0.027   -0.299  H100 EIW 250 
EIW H101 H101 H 0 0 N N N 126.495 137.097 154.969 10.662  -1.138  1.447   H101 EIW 251 
EIW H102 H102 H 0 0 N N N 126.282 135.582 154.028 11.312  -2.247  0.216   H102 EIW 252 
EIW H103 H103 H 0 0 N N N 125.794 134.776 156.194 12.309  -0.324  -0.990  H103 EIW 253 
EIW H104 H104 H 0 0 N N N 127.566 134.486 156.158 11.660  0.786   0.241   H104 EIW 254 
EIW H105 H105 H 0 0 N N N 127.963 136.008 157.838 12.980  -0.379  1.987   H105 EIW 255 
EIW H106 H106 H 0 0 N N N 126.847 137.221 157.123 13.630  -1.488  0.756   H106 EIW 256 
EIW H107 H107 H 0 0 N N N 126.101 136.457 159.425 14.628  0.435   -0.450  H107 EIW 257 
EIW H108 H108 H 0 0 N N N 124.887 136.090 158.154 13.978  1.545   0.781   H108 EIW 258 
EIW H109 H109 H 0 0 N N N 125.147 134.173 159.728 15.299  0.380   2.527   H109 EIW 259 
EIW H110 H110 H 0 0 N N N 125.685 133.723 158.075 15.948  -0.729  1.296   H110 EIW 260 
EIW H111 H111 H 0 0 N N N 126.900 134.090 159.346 16.354  1.003   1.237   H111 EIW 261 
EIW H112 H112 H 0 0 N N N 127.404 134.272 146.962 4.104   -6.103  -2.016  H112 EIW 262 
EIW H113 H113 H 0 0 N N N 127.986 133.300 148.356 4.908   -5.055  -3.208  H113 EIW 263 
EIW H114 H114 H 0 0 N N N 125.806 135.090 149.183 6.943   -5.002  -1.791  H114 EIW 264 
EIW H115 H115 H 0 0 N N N 125.300 134.081 147.786 6.139   -6.051  -0.598  H115 EIW 265 
EIW H116 H116 H 0 0 N N N 124.905 132.395 149.235 5.894   -7.820  -2.319  H116 EIW 266 
EIW H117 H117 H 0 0 N N N 126.674 132.313 149.538 6.698   -6.771  -3.511  H117 EIW 267 
EIW H118 H118 H 0 0 N N N 126.380 134.092 151.264 8.732   -6.719  -2.094  H118 EIW 268 
EIW H119 H119 H 0 0 N N N 124.605 133.942 151.034 7.928   -7.768  -0.901  H119 EIW 269 
EIW H120 H120 H 0 0 N N N 126.567 132.001 152.241 7.684   -9.537  -2.622  H120 EIW 270 
EIW H121 H121 H 0 0 N N N 125.003 132.609 152.884 8.488   -8.488  -3.814  H121 EIW 271 
EIW H122 H122 H 0 0 N N N 123.741 131.186 151.495 10.522  -8.436  -2.397  H122 EIW 272 
EIW H123 H123 H 0 0 N N N 125.128 130.875 150.397 9.718   -9.484  -1.204  H123 EIW 273 
EIW H124 H124 H 0 0 N N N 124.421 129.596 153.034 9.474   -11.253 -2.925  H124 EIW 274 
EIW H125 H125 H 0 0 N N N 126.167 129.883 152.724 10.278  -10.205 -4.117  H125 EIW 275 
EIW H126 H126 H 0 0 N N N 126.271 128.327 151.070 12.312  -10.153 -2.700  H126 EIW 276 
EIW H127 H127 H 0 0 N N N 124.621 128.703 150.466 11.508  -11.201 -1.508  H127 EIW 277 
EIW H128 H128 H 0 0 N N N 123.869 127.563 152.736 11.263  -12.970 -3.228  H128 EIW 278 
EIW H129 H129 H 0 0 N N N 125.498 126.811 152.653 12.067  -11.922 -4.420  H129 EIW 279 
EIW H130 H130 H 0 0 N N N 124.933 126.019 150.322 14.101  -11.869 -3.003  H130 EIW 280 
EIW H131 H131 H 0 0 N N N 123.264 126.632 150.574 13.297  -12.918 -1.811  H131 EIW 281 
EIW H132 H132 H 0 0 N N N 123.404 124.203 151.004 14.762  -14.239 -3.313  H132 EIW 282 
EIW H133 H133 H 0 0 N N N 124.664 124.492 152.251 13.053  -14.687 -3.531  H133 EIW 283 
EIW H134 H134 H 0 0 N N N 122.994 125.105 152.503 13.857  -13.639 -4.723  H134 EIW 284 
EIW H135 H135 H 0 0 N N N 138.388 133.698 143.963 -6.082  -1.335  3.831   H135 EIW 285 
EIW H136 H136 H 0 0 N N N 138.196 130.989 144.813 -7.734  0.515   4.128   H136 EIW 286 
EIW H137 H137 H 0 0 N N N 140.908 133.406 146.963 -6.214  -1.521  8.327   H137 EIW 287 
EIW H138 H138 H 0 0 N N N 142.641 134.342 148.185 -5.581  0.641   10.384  H138 EIW 288 
EIW H139 H139 H 0 0 N N N 141.484 135.716 148.238 -4.409  -0.557  9.785   H139 EIW 289 
EIW H140 H140 H 0 0 N N N 143.465 134.736 151.394 -4.135  -1.449  12.103  H140 EIW 290 
EIW H141 H141 H 0 0 N N N 143.502 135.819 149.961 -5.307  -0.251  12.702  H141 EIW 291 
EIW H142 H142 H 0 0 N N N 144.034 136.814 153.073 -3.862  -2.341  14.420  H142 EIW 292 
EIW H143 H143 H 0 0 N N N 144.259 137.719 151.538 -5.033  -1.143  15.020  H143 EIW 293 
EIW H144 H144 H 0 0 N N N 136.190 132.552 146.351 -6.967  2.847   3.637   H144 EIW 294 
EIW H145 H145 H 0 0 N N N 138.467 128.881 149.063 -8.207  4.869   -0.496  H145 EIW 295 
EIW H146 H146 H 0 0 N N N 137.685 130.852 150.967 -9.057  3.637   -2.514  H146 EIW 296 
EIW H147 H147 H 0 0 N N N 137.898 129.326 151.891 -10.644 3.499   -1.719  H147 EIW 297 
EIW H148 H148 H 0 0 N N N 140.208 129.096 151.168 -10.786 5.970   -1.575  H148 EIW 298 
EIW H149 H149 H 0 0 N N N 140.018 130.365 149.911 -9.200  6.108   -2.369  H149 EIW 299 
EIW H150 H150 H 0 0 N N N 141.300 131.115 151.974 -10.099 4.948   -4.368  H150 EIW 300 
EIW H151 H151 H 0 0 N N N 139.857 132.114 151.594 -11.686 4.810   -3.573  H151 EIW 301 
EIW H152 H152 H 0 0 N N N 138.561 130.772 153.294 -10.242 7.419   -4.223  H152 EIW 302 
EIW H153 H153 H 0 0 N N N 140.093 129.945 153.739 -11.829 7.281   -3.428  H153 EIW 303 
EIW H154 H154 H 0 0 N N N 140.112 131.780 158.322 -13.914 9.903   -7.136  H154 EIW 304 
EIW H155 H155 H 0 0 N N N 141.658 130.866 158.271 -12.328 10.042  -7.930  H155 EIW 305 
EIW H156 H156 H 0 0 N N N 141.814 132.236 160.941 -14.957 11.215  -8.989  H156 EIW 306 
EIW H157 H157 H 0 0 N N N 142.919 131.319 159.862 -13.370 11.353  -9.784  H157 EIW 307 
EIW H158 H158 H 0 0 N N N 131.560 133.145 146.731 -0.648  -2.569  1.481   H158 EIW 308 
EIW H159 H159 H 0 0 N N N 139.456 132.156 146.388 -5.282  1.592   5.294   H159 EIW 309 
EIW H160 H160 H 0 0 N N N 134.823 129.747 145.480 -4.047  3.651   1.750   H160 EIW 310 
EIW H161 H161 H 0 0 N N N 129.996 136.011 138.039 -0.138  6.635   -2.697  H161 EIW 311 
EIW H162 H162 H 0 0 N N N 137.169 134.611 138.831 2.460   8.289   2.366   H162 EIW 312 
EIW H163 H163 H 0 0 N N N 137.165 136.209 139.826 0.983   6.059   5.020   H163 EIW 313 
EIW H164 H164 H 0 0 N N N 133.479 138.008 136.809 -2.568  7.735   4.391   H164 EIW 314 
EIW H165 H165 H 0 0 N N N 128.149 138.932 143.633 3.392   2.909   -2.109  H165 EIW 315 
EIW H166 H166 H 0 0 N N N 127.137 136.283 141.597 5.623   0.757   -2.707  H166 EIW 316 
EIW H167 H167 H 0 0 N N N 141.420 132.560 143.198 -8.054  -2.890  -0.377  H167 EIW 317 
EIW H168 H168 H 0 0 N N N 140.036 129.368 143.004 -5.087  -2.405  0.409   H168 EIW 318 
EIW H169 H169 H 0 0 N N N 139.541 132.255 148.507 -7.735  0.779   9.236   H169 EIW 319 
EIW H170 H170 H 0 0 N N N 137.750 127.353 150.640 -10.781 4.144   0.635   H170 EIW 320 
EIW H171 H171 H 0 0 N N N 133.560 131.314 134.986 6.704   5.445   -0.572  H171 EIW 321 
EIW H172 H172 H 0 0 N N N 136.309 132.861 132.921 8.069   3.224   2.124   H172 EIW 322 
EIW H173 H173 H 0 0 N N N 138.031 130.844 133.735 6.688   0.570   2.764   H173 EIW 323 
EIW H174 H174 H 0 0 N N N 138.345 131.953 136.598 4.193   0.708   2.478   H174 EIW 324 
EIW H175 H175 H 0 0 N N N 138.236 130.222 136.129 4.181   2.102   3.585   H175 EIW 325 
EIW H176 H176 H 0 0 N N N 132.053 132.828 135.948 6.857   6.387   1.619   H176 EIW 326 
EIW H177 H177 H 0 0 N N N 136.317 130.573 132.444 8.312   0.851   1.743   H177 EIW 327 
EIW H178 H178 H 0 0 N N N 139.248 132.800 133.887 6.338   3.067   4.202   H178 EIW 328 
EIW H179 H179 H 0 0 N N N 134.270 136.658 134.179 11.205  3.492   -1.542  H179 EIW 329 
EIW H180 H180 H 0 0 N N N 130.945 136.728 132.412 10.550  7.020   -2.634  H180 EIW 330 
EIW H181 H181 H 0 0 N N N 129.451 134.581 131.728 8.307   8.644   -1.237  H181 EIW 331 
EIW H182 H182 H 0 0 N N N 133.175 138.372 133.001 10.620  3.815   -3.838  H182 EIW 332 
EIW H183 H183 H 0 0 N N N 132.492 137.848 135.335 13.130  5.075   -1.156  H183 EIW 333 
EIW H184 H184 H 0 0 N N N 129.654 136.428 134.343 11.717  8.199   -0.915  H184 EIW 334 
EIW H185 H185 H 0 0 N N N 130.655 136.056 130.408 8.213   7.290   -3.804  H185 EIW 335 
EIW H186 H186 H 0 0 N N N 131.215 131.764 129.494 4.862   8.485   -2.027  H186 EIW 336 
# 
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 
EIW OCH CCB  SING N N 1   
EIW OCG CCA  SING N N 2   
EIW CCB CCA  SING N N 3   
EIW CCA CBZ  SING N N 4   
EIW OCF CBZ  SING N N 5   
EIW OCF CBV  SING N N 6   
EIW CBZ CBY  SING N N 7   
EIW OCC CBW  SING N N 8   
EIW OBR CBL  SING N N 9   
EIW CBV CBW  SING N N 10  
EIW CBV OBQ  SING N N 11  
EIW CBY OCE  SING N N 12  
EIW CBY CBX  SING N N 13  
EIW CBW CBX  SING N N 14  
EIW CBL CBK  SING N N 15  
EIW CBL CBM  SING N N 16  
EIW OBQ CBK  SING N N 17  
EIW CBK CBJ  SING N N 18  
EIW OBT CBN  SING N N 19  
EIW CBX OCD  SING N N 20  
EIW CBN CBM  SING N N 21  
EIW CBN CBO  SING N N 22  
EIW CBM OBS  SING N N 23  
EIW CBJ OBP  SING N N 24  
EIW CBJ CBI  SING N N 25  
EIW OBU CBO  SING N N 26  
EIW OBS CBI  SING N N 27  
EIW CBI O48  SING N N 28  
EIW O48 C47  SING N N 29  
EIW O70 C69  SING N N 30  
EIW C47 C46  SING N N 31  
EIW C47 C64  SING N N 32  
EIW O65 C64  SING N N 33  
EIW C69 C67  SING N N 34  
EIW O45 C43  DOUB N N 35  
EIW O44 C43  SING N N 36  
EIW C46 C42  SING N N 37  
EIW C43 C42  SING N N 38  
EIW C67 C66  SING N N 39  
EIW C67 O68  SING N N 40  
EIW C64 C66  SING N N 41  
EIW O71 C42  SING N N 42  
EIW O71 C66  SING N N 43  
EIW C42 O41  SING N N 44  
EIW O41 C40  SING N N 45  
EIW OAH PAE  DOUB N N 46  
EIW C40 C39  SING N N 47  
EIW O77 P74  DOUB N N 48  
EIW O76 P74  SING N N 49  
EIW C04 C03  SING N N 50  
EIW C04 O05  SING N N 51  
EIW OAD PAE  SING N N 52  
EIW OAD CAC  SING N N 53  
EIW C39 O38  SING N N 54  
EIW C39 C72  SING N N 55  
EIW PAE OAG  SING N N 56  
EIW PAE OAF  SING N N 57  
EIW P74 O75  SING N N 58  
EIW P74 O73  SING N N 59  
EIW O38 C06  SING N N 60  
EIW C03 OAB  SING N N 61  
EIW C03 C02  SING N N 62  
EIW OAB CAC  SING N N 63  
EIW O05 C06  SING N N 64  
EIW CAC CAI  SING N N 65  
EIW C72 O73  SING N N 66  
EIW C72 C78  SING N N 67  
EIW C06 C07  SING N N 68  
EIW O01 C02  SING N N 69  
EIW C02 CB0  SING N N 70  
EIW CAI CB0  SING N N 71  
EIW CAI NAJ  SING N N 72  
EIW C78 C07  SING N N 73  
EIW C78 O79  SING N N 74  
EIW C07 N08  SING N N 75  
EIW CB0 OB1  SING N N 76  
EIW NAJ CAK  SING N N 77  
EIW O79 C80  SING N N 78  
EIW OAZ CAK  DOUB N N 79  
EIW OB1 CB2  SING N N 80  
EIW N08 C09  SING N N 81  
EIW CAK CAL  SING N N 82  
EIW C80 OAA  DOUB N N 83  
EIW C80 C81  SING N N 84  
EIW O37 C09  DOUB N N 85  
EIW C09 C10  SING N N 86  
EIW CAL CAM  SING N N 87  
EIW CB2 OBH  DOUB N N 88  
EIW CB2 CB3  SING N N 89  
EIW CAM CAO  SING N N 90  
EIW CAM OAN  SING N N 91  
EIW C81 C82  SING N N 92  
EIW C99 C82  SING N N 93  
EIW C99 CA0  SING N N 94  
EIW CAO CAP  SING N N 95  
EIW C82 O83  SING N N 96  
EIW CA0 CA1  SING N N 97  
EIW C10 C11  SING N N 98  
EIW CB3 CB4  SING N N 99  
EIW CA1 CA2  SING N N 100 
EIW CB4 OB5  SING N N 101 
EIW CB4 CB6  SING N N 102 
EIW O83 C84  SING N N 103 
EIW C11 O12  SING N N 104 
EIW C11 C26  SING N N 105 
EIW CAP CAQ  SING N N 106 
EIW O98 C84  DOUB N N 107 
EIW O12 C13  SING N N 108 
EIW C84 C85  SING N N 109 
EIW C27 C26  SING N N 110 
EIW C27 C28  SING N N 111 
EIW CAQ CAR  SING N N 112 
EIW CB7 CB6  SING N N 113 
EIW CB7 CB8  SING N N 114 
EIW CA2 CA3  SING N N 115 
EIW CA8 CA9  SING N N 116 
EIW CA8 CA7  SING N N 117 
EIW CA6 CA7  SING N N 118 
EIW CA6 CA5  SING N N 119 
EIW CA4 CA3  SING N N 120 
EIW CA4 CA5  SING N N 121 
EIW C28 C29  SING N N 122 
EIW CAR CAS  SING N N 123 
EIW C13 O25  DOUB N N 124 
EIW C13 C14  SING N N 125 
EIW C85 C86  SING N N 126 
EIW CB8 CB9  SING N N 127 
EIW CAS CAT  SING N N 128 
EIW C29 C30  SING N N 129 
EIW C14 C15  SING N N 130 
EIW C86 C87  SING N N 131 
EIW C30 C31  SING N N 132 
EIW CB9 CBA  SING N N 133 
EIW C87 C88  SING N N 134 
EIW CBA CBB  SING N N 135 
EIW C15 C16  SING N N 136 
EIW C31 C32  SING N N 137 
EIW C88 C89  SING N N 138 
EIW C32 C33  SING N N 139 
EIW C16 C17  SING N N 140 
EIW CBB CBC  SING N N 141 
EIW C89 C90  SING N N 142 
EIW C17 C18  SING N N 143 
EIW CBC CBD  SING N N 144 
EIW C33 C34  SING N N 145 
EIW C18 C19  SING N N 146 
EIW C90 C91  SING N N 147 
EIW C34 C35  SING N N 148 
EIW CBD CBE  SING N N 149 
EIW C35 C36  SING N N 150 
EIW C91 C92  SING N N 151 
EIW C19 C20  SING N N 152 
EIW CBE CBF  SING N N 153 
EIW CBF CBG  SING N N 154 
EIW CAL H1   SING N N 155 
EIW CAL H2   SING N N 156 
EIW CAP H3   SING N N 157 
EIW CAP H4   SING N N 158 
EIW CAR H5   SING N N 159 
EIW CAR H6   SING N N 160 
EIW CAT H7   SING N N 161 
EIW CAT H8   SING N N 162 
EIW CAT H9   SING N N 163 
EIW CBA H10  SING N N 164 
EIW CBA H11  SING N N 165 
EIW CBB H12  SING N N 166 
EIW CBB H13  SING N N 167 
EIW CBC H14  SING N N 168 
EIW CBC H15  SING N N 169 
EIW CBE H16  SING N N 170 
EIW CBE H17  SING N N 171 
EIW CBG H18  SING N N 172 
EIW CBG H19  SING N N 173 
EIW CBG H20  SING N N 174 
EIW CBI H21  SING N N 175 
EIW CBK H22  SING N N 176 
EIW CBM H23  SING N N 177 
EIW CBV H24  SING N N 178 
EIW CBX H25  SING N N 179 
EIW CBZ H26  SING N N 180 
EIW CCB H27  SING N N 181 
EIW CCB H28  SING N N 182 
EIW OBU H29  SING N N 183 
EIW CB3 H30  SING N N 184 
EIW CB3 H31  SING N N 185 
EIW C02 H32  SING N N 186 
EIW C03 H33  SING N N 187 
EIW C04 H34  SING N N 188 
EIW C04 H35  SING N N 189 
EIW C06 H36  SING N N 190 
EIW C07 H37  SING N N 191 
EIW C10 H38  SING N N 192 
EIW C10 H39  SING N N 193 
EIW C11 H40  SING N N 194 
EIW C14 H41  SING N N 195 
EIW C14 H42  SING N N 196 
EIW C15 H43  SING N N 197 
EIW C15 H44  SING N N 198 
EIW C16 H45  SING N N 199 
EIW C16 H46  SING N N 200 
EIW C17 H47  SING N N 201 
EIW C17 H48  SING N N 202 
EIW C18 H49  SING N N 203 
EIW C18 H50  SING N N 204 
EIW C19 H51  SING N N 205 
EIW C19 H52  SING N N 206 
EIW C20 H53  SING N N 207 
EIW C20 H54  SING N N 208 
EIW C20 H55  SING N N 209 
EIW C26 H56  SING N N 210 
EIW C26 H57  SING N N 211 
EIW C27 H58  SING N N 212 
EIW C27 H59  SING N N 213 
EIW C28 H60  SING N N 214 
EIW C28 H61  SING N N 215 
EIW C29 H62  SING N N 216 
EIW C29 H63  SING N N 217 
EIW C30 H64  SING N N 218 
EIW C30 H65  SING N N 219 
EIW C31 H66  SING N N 220 
EIW C31 H67  SING N N 221 
EIW C32 H68  SING N N 222 
EIW C32 H69  SING N N 223 
EIW C33 H70  SING N N 224 
EIW C33 H71  SING N N 225 
EIW C34 H72  SING N N 226 
EIW C34 H73  SING N N 227 
EIW C35 H74  SING N N 228 
EIW C35 H75  SING N N 229 
EIW C36 H76  SING N N 230 
EIW C36 H77  SING N N 231 
EIW C36 H78  SING N N 232 
EIW C39 H79  SING N N 233 
EIW C40 H80  SING N N 234 
EIW C40 H81  SING N N 235 
EIW C46 H82  SING N N 236 
EIW C46 H83  SING N N 237 
EIW C47 H84  SING N N 238 
EIW C64 H85  SING N N 239 
EIW C66 H86  SING N N 240 
EIW C67 H87  SING N N 241 
EIW C69 H88  SING N N 242 
EIW C69 H89  SING N N 243 
EIW C72 H90  SING N N 244 
EIW C78 H91  SING N N 245 
EIW C81 H92  SING N N 246 
EIW C81 H93  SING N N 247 
EIW C82 H94  SING N N 248 
EIW C85 H95  SING N N 249 
EIW C85 H96  SING N N 250 
EIW C86 H97  SING N N 251 
EIW C86 H98  SING N N 252 
EIW C87 H99  SING N N 253 
EIW C87 H100 SING N N 254 
EIW C88 H101 SING N N 255 
EIW C88 H102 SING N N 256 
EIW C89 H103 SING N N 257 
EIW C89 H104 SING N N 258 
EIW C90 H105 SING N N 259 
EIW C90 H106 SING N N 260 
EIW C91 H107 SING N N 261 
EIW C91 H108 SING N N 262 
EIW C92 H109 SING N N 263 
EIW C92 H110 SING N N 264 
EIW C92 H111 SING N N 265 
EIW C99 H112 SING N N 266 
EIW C99 H113 SING N N 267 
EIW CA0 H114 SING N N 268 
EIW CA0 H115 SING N N 269 
EIW CA1 H116 SING N N 270 
EIW CA1 H117 SING N N 271 
EIW CA2 H118 SING N N 272 
EIW CA2 H119 SING N N 273 
EIW CA3 H120 SING N N 274 
EIW CA3 H121 SING N N 275 
EIW CA4 H122 SING N N 276 
EIW CA4 H123 SING N N 277 
EIW CA5 H124 SING N N 278 
EIW CA5 H125 SING N N 279 
EIW CA6 H126 SING N N 280 
EIW CA6 H127 SING N N 281 
EIW CA7 H128 SING N N 282 
EIW CA7 H129 SING N N 283 
EIW CA8 H130 SING N N 284 
EIW CA8 H131 SING N N 285 
EIW CA9 H132 SING N N 286 
EIW CA9 H133 SING N N 287 
EIW CA9 H134 SING N N 288 
EIW CAC H135 SING N N 289 
EIW CAI H136 SING N N 290 
EIW CAM H137 SING N N 291 
EIW CAO H138 SING N N 292 
EIW CAO H139 SING N N 293 
EIW CAQ H140 SING N N 294 
EIW CAQ H141 SING N N 295 
EIW CAS H142 SING N N 296 
EIW CAS H143 SING N N 297 
EIW CB0 H144 SING N N 298 
EIW CB4 H145 SING N N 299 
EIW CB6 H146 SING N N 300 
EIW CB6 H147 SING N N 301 
EIW CB7 H148 SING N N 302 
EIW CB7 H149 SING N N 303 
EIW CB8 H150 SING N N 304 
EIW CB8 H151 SING N N 305 
EIW CB9 H152 SING N N 306 
EIW CB9 H153 SING N N 307 
EIW CBD H154 SING N N 308 
EIW CBD H155 SING N N 309 
EIW CBF H156 SING N N 310 
EIW CBF H157 SING N N 311 
EIW N08 H158 SING N N 312 
EIW NAJ H159 SING N N 313 
EIW O01 H160 SING N N 314 
EIW O44 H161 SING N N 315 
EIW O65 H162 SING N N 316 
EIW O68 H163 SING N N 317 
EIW O70 H164 SING N N 318 
EIW O75 H165 SING N N 319 
EIW O76 H166 SING N N 320 
EIW OAF H167 SING N N 321 
EIW OAG H168 SING N N 322 
EIW OAN H169 SING N N 323 
EIW OB5 H170 SING N N 324 
EIW CBJ H171 SING N N 325 
EIW CBL H172 SING N N 326 
EIW CBN H173 SING N N 327 
EIW CBO H174 SING N N 328 
EIW CBO H175 SING N N 329 
EIW OBP H176 SING N N 330 
EIW OBR H177 SING N N 331 
EIW OBT H178 SING N N 332 
EIW CBW H179 SING N N 333 
EIW CBY H180 SING N N 334 
EIW CCA H181 SING N N 335 
EIW OCC H182 SING N N 336 
EIW OCD H183 SING N N 337 
EIW OCE H184 SING N N 338 
EIW OCG H185 SING N N 339 
EIW OCH H186 SING N N 340 
# 
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 
EIW InChI            InChI                1.06  "InChI=1S/C102H186N2O44P2/c1-7-13-19-25-29-32-35-39-44-50-66(109)56-79(117)141-94-81(103-75(113)55-65(108)49-43-24-18-12-6)98(148-150(131,132)133)139-73(84(94)120)63-134-97-82(104-76(114)57-67(136-77(115)53-47-38-23-17-11-5)51-45-40-36-33-30-26-20-14-8-2)95(142-80(118)58-68(52-46-41-37-34-31-27-21-15-9-3)137-78(116)54-48-42-28-22-16-10-4)93(147-149(128,129)130)74(140-97)64-135-102(101(126)127)59-72(83(119)92(146-102)71(112)62-107)138-100-89(125)96(88(124)91(144-100)70(111)61-106)145-99-87(123)85(121)86(122)90(143-99)69(110)60-105/h65-74,81-100,105-112,119-125H,7-64H2,1-6H3,(H,103,113)(H,104,114)(H,126,127)(H2,128,129,130)(H2,131,132,133)/t65-,66-,67-,68-,69+,70+,71-,72-,73-,74-,81+,82-,83-,84-,85+,86+,87+,88-,89+,90-,91-,92-,93-,94+,95-,96+,97-,98-,99-,100-,102-/m1/s1" 
EIW InChIKey         InChI                1.06  VKAAKLVZEGKXRM-AYTPQRGYSA-N                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                 
EIW SMILES_CANONICAL CACTVS               3.385 "CCCCCCCCCCC[C@@H](O)CC(=O)O[C@@H]1[C@H](O)[C@@H](CO[C@@H]2O[C@H](CO[C@@]3(C[C@@H](O[C@@H]4O[C@H]([C@@H](O)CO)[C@@H](O)[C@H](O[C@H]5O[C@H]([C@@H](O)CO)[C@@H](O)[C@H](O)[C@@H]5O)[C@@H]4O)[C@@H](O)[C@H](O3)[C@H](O)CO)C(O)=O)[C@@H](O[P](O)(O)=O)[C@H](OC(=O)C[C@@H](CCCCCCCCCCC)OC(=O)CCCCCCCC)[C@H]2NC(=O)C[C@@H](CCCCCCCCCCC)OC(=O)CCCCCCC)O[C@H](O[P](O)(O)=O)[C@H]1NC(=O)C[C@H](O)CCCCCC"                                                                                                                                                                                                                                                                                                                                                                                                             
EIW SMILES           CACTVS               3.385 "CCCCCCCCCCC[CH](O)CC(=O)O[CH]1[CH](O)[CH](CO[CH]2O[CH](CO[C]3(C[CH](O[CH]4O[CH]([CH](O)CO)[CH](O)[CH](O[CH]5O[CH]([CH](O)CO)[CH](O)[CH](O)[CH]5O)[CH]4O)[CH](O)[CH](O3)[CH](O)CO)C(O)=O)[CH](O[P](O)(O)=O)[CH](OC(=O)C[CH](CCCCCCCCCCC)OC(=O)CCCCCCCC)[CH]2NC(=O)C[CH](CCCCCCCCCCC)OC(=O)CCCCCCC)O[CH](O[P](O)(O)=O)[CH]1NC(=O)C[CH](O)CCCCCC"                                                                                                                                                                                                                                                                                                                                                                                                                                                             
EIW SMILES_CANONICAL "OpenEye OEToolkits" 2.0.7 "CCCCCCCCCCC[C@H](CC(=O)O[C@H]1[C@@H]([C@H](O[C@@H]([C@H]1O)CO[C@H]2[C@@H]([C@H]([C@@H]([C@H](O2)CO[C@@]3(C[C@H]([C@H]([C@H](O3)[C@@H](CO)O)O)O[C@H]4[C@H]([C@H]([C@@H]([C@H](O4)[C@H](CO)O)O)O[C@@H]5[C@H]([C@H]([C@@H]([C@H](O5)[C@H](CO)O)O)O)O)O)C(=O)O)OP(=O)(O)O)OC(=O)C[C@@H](CCCCCCCCCCC)OC(=O)CCCCCCCC)NC(=O)C[C@@H](CCCCCCCCCCC)OC(=O)CCCCCCC)OP(=O)(O)O)NC(=O)C[C@@H](CCCCCC)O)O"                                                                                                                                                                                                                                                                                                                                                                                                                
EIW SMILES           "OpenEye OEToolkits" 2.0.7 "CCCCCCCCCCCC(CC(=O)OC1C(C(OC(C1O)COC2C(C(C(C(O2)COC3(CC(C(C(O3)C(CO)O)O)OC4C(C(C(C(O4)C(CO)O)O)OC5C(C(C(C(O5)C(CO)O)O)O)O)O)C(=O)O)OP(=O)(O)O)OC(=O)CC(CCCCCCCCCCC)OC(=O)CCCCCCCC)NC(=O)CC(CCCCCCCCCCC)OC(=O)CCCCCCC)OP(=O)(O)O)NC(=O)CC(CCCCCC)O)O"                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                       
# 
_pdbx_chem_comp_identifier.comp_id           EIW 
_pdbx_chem_comp_identifier.type              "SYSTEMATIC NAME" 
_pdbx_chem_comp_identifier.program           "OpenEye OEToolkits" 
_pdbx_chem_comp_identifier.program_version   2.0.7 
_pdbx_chem_comp_identifier.identifier        "(2~{R},4~{R},5~{R},6~{R})-6-[(1~{R})-1,2-bis(oxidanyl)ethyl]-4-[(2~{R},3~{S},4~{S},5~{R},6~{R})-6-[(1~{S})-1,2-bis(oxidanyl)ethyl]-4-[(2~{R},3~{S},4~{S},5~{S},6~{R})-6-[(1~{S})-1,2-bis(oxidanyl)ethyl]-3,4,5-tris(oxidanyl)oxan-2-yl]oxy-3,5-bis(oxidanyl)oxan-2-yl]oxy-2-[[(2~{R},3~{S},4~{R},5~{R},6~{R})-4-[(3~{R})-3-nonanoyloxytetradecanoyl]oxy-5-[[(3~{R})-3-octanoyloxytetradecanoyl]amino]-6-[[(2~{R},3~{S},4~{S},5~{S},6~{R})-3-oxidanyl-5-[[(3~{R})-3-oxidanylnonanoyl]amino]-4-[(3~{R})-3-oxidanyltetradecanoyl]oxy-6-phosphonooxy-oxan-2-yl]methoxy]-3-phosphonooxy-oxan-2-yl]methoxy]-5-oxidanyl-oxane-2-carboxylic acid" 
# 
loop_
_pdbx_chem_comp_audit.comp_id 
_pdbx_chem_comp_audit.action_type 
_pdbx_chem_comp_audit.date 
_pdbx_chem_comp_audit.processing_site 
EIW "Create component"  2022-01-07 PDBE 
EIW "Initial release"   2022-08-24 RCSB 
EIW "Modify descriptor" 2022-08-22 RCSB 
# 
