data_BIZ
# 
_chem_comp.id                                    BIZ 
_chem_comp.name                                  BIZELESIN 
_chem_comp.type                                  NON-POLYMER 
_chem_comp.pdbx_type                             HETAIN 
_chem_comp.formula                               "C43 H38 N8 O5" 
_chem_comp.mon_nstd_parent_comp_id               ? 
_chem_comp.pdbx_synonyms                         ? 
_chem_comp.pdbx_formal_charge                    0 
_chem_comp.pdbx_initial_date                     1999-07-08 
_chem_comp.pdbx_modified_date                    2008-10-14 
_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                        746.812 
_chem_comp.one_letter_code                       ? 
_chem_comp.three_letter_code                     BIZ 
_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        226D 
_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 
BIZ C      C    C 0 1 N N N -6.449  0.841   2.988  -3.257 -0.063 0.160   C      BIZ 1  
BIZ O      O    O 0 1 N N N -7.093  0.402   3.850  -2.072 -0.288 0.315   O      BIZ 2  
BIZ N1     N1   N 0 1 N N N -6.489  0.371   1.769  -4.078 -0.006 1.227   N1     BIZ 3  
BIZ C2     C2   C 0 1 Y N N -7.073  -0.843  1.313  -3.549 -0.092 2.523   C2     BIZ 4  
BIZ C3     C3   C 0 1 Y N N -6.279  -1.816  0.730  -2.306 0.442  2.794   C3     BIZ 5  
BIZ C4     C4   C 0 1 Y N N -6.784  -3.026  0.267  -1.782 0.354  4.090   C4     BIZ 6  
BIZ C5     C5   C 0 1 Y N N -8.175  -3.207  0.361  -2.527 -0.277 5.104   C5     BIZ 7  
BIZ C6     C6   C 0 1 Y N N -9.003  -2.240  0.905  -3.779 -0.809 4.808   C6     BIZ 8  
BIZ C7     C7   C 0 1 Y N N -8.439  -1.068  1.380  -4.283 -0.716 3.531   C7     BIZ 9  
BIZ N8     N8   N 0 1 Y N N -8.389  -4.417  -0.237 -1.780 -0.220 6.259   N8     BIZ 10 
BIZ C9     C9   C 0 1 Y N N -7.236  -5.010  -0.668 -0.592 0.429  5.989   C9     BIZ 11 
BIZ C10    C10  C 0 1 Y N N -6.214  -4.209  -0.339 -0.572 0.793  4.680   C10    BIZ 12 
BIZ C11    C11  C 0 1 N N N -7.416  -6.299  -1.373 0.476  0.692  6.963   C11    BIZ 13 
BIZ O12    O12  O 0 1 N N N -8.563  -6.634  -1.586 1.460  1.325  6.631   O12    BIZ 14 
BIZ N13    N13  N 0 1 N N N -6.408  -7.032  -1.809 0.365  0.231  8.225   N13    BIZ 15 
BIZ C14    C14  C 0 1 N N N -5.046  -6.959  -1.365 -0.772 -0.531 8.744   C14    BIZ 16 
BIZ C15    C15  C 0 1 N N S -4.353  -8.211  -1.858 -0.424 -0.817 10.214  C15    BIZ 17 
BIZ C16    C16  C 0 1 Y N N -5.151  -8.577  -3.067 0.926  -0.171 10.421  C16    BIZ 18 
BIZ C17    C17  C 0 1 Y N N -6.351  -7.901  -2.932 1.321  0.412  9.233   C17    BIZ 19 
BIZ C18    C18  C 0 1 N N N -3.866  -9.379  -1.041 -0.338 -2.325 10.459  C18    BIZ 20 
BIZ C19    C19  C 0 1 Y N N -7.339  -8.037  -3.886 2.553  1.079  9.170   C19    BIZ 21 
BIZ C20    C20  C 0 1 Y N N -7.183  -8.843  -4.998 3.373  1.157  10.274  C20    BIZ 22 
BIZ O21    O21  O 0 1 N N N -8.097  -8.987  -5.936 4.564  1.808  10.191  O21    BIZ 23 
BIZ C22    C22  C 0 1 Y N N -5.886  -9.516  -5.090 2.983  0.569  11.478  C22    BIZ 24 
BIZ C23    C23  C 0 1 Y N N -4.855  -9.389  -4.152 1.750  -0.098 11.547  C23    BIZ 25 
BIZ C24    C24  C 0 1 Y N N -3.719  -10.123 -4.649 1.635  -0.596 12.920  C24    BIZ 26 
BIZ C25    C25  C 0 1 Y N N -4.121  -10.705 -5.771 2.748  -0.219 13.569  C25    BIZ 27 
BIZ C26    C26  C 0 1 N N N -2.326  -10.170 -4.172 0.486  -1.383 13.495  C26    BIZ 28 
BIZ N27    N27  N 0 1 Y N N -5.415  -10.369 -6.030 3.567  0.478  12.725  N27    BIZ 29 
BIZ "N1'"  *N1  N 0 1 N N N -5.649  1.844   3.151  -3.749 0.129  -1.079  "N1'"  BIZ 30 
BIZ "C2'"  *C2  C 0 1 Y N N -5.317  2.588   4.316  -2.926 -0.059 -2.197  "C2'"  BIZ 31 
BIZ "C3'"  *C3  C 0 1 Y N N -4.056  3.078   4.493  -3.127 0.696  -3.334  "C3'"  BIZ 32 
BIZ "C4'"  *C4  C 0 1 Y N N -3.700  3.865   5.580  -2.298 0.508  -4.448  "C4'"  BIZ 33 
BIZ "C5'"  *C5  C 0 1 Y N N -4.664  4.146   6.526  -1.275 -0.458 -4.401  "C5'"  BIZ 34 
BIZ "C6'"  *C6  C 0 1 Y N N -5.908  3.627   6.403  -1.093 -1.213 -3.247  "C6'"  BIZ 35 
BIZ "C7'"  *C7  C 0 1 Y N N -6.224  2.867   5.289  -1.911 -1.015 -2.158  "C7'"  BIZ 36 
BIZ "N8'"  *N8  N 0 1 Y N N -4.043  4.953   7.426  -0.630 -0.432 -5.618  "N8'"  BIZ 37 
BIZ "C9'"  *C9  C 0 1 Y N N -2.796  5.269   7.053  -1.227 0.524  -6.417  "C9'"  BIZ 38 
BIZ "CA'"  *C10 C 0 1 Y N N -2.510  4.547   5.972  -2.242 1.109  -5.729  "CA'"  BIZ 39 
BIZ "CB'"  *C11 C 0 1 N N N -2.108  6.280   7.877  -0.826 0.856  -7.791  "CB'"  BIZ 40 
BIZ "OC'"  *O12 O 0 1 N N N -2.681  6.664   8.866  -1.385 1.758  -8.387  "OC'"  BIZ 41 
BIZ "ND'"  *N13 N 0 1 N N N -0.951  6.776   7.535  0.160  0.162  -8.392  "ND'"  BIZ 42 
BIZ "CE'"  *C14 C 0 1 N N N -0.306  6.586   6.269  0.910  -0.935 -7.777  "CE'"  BIZ 43 
BIZ "CF'"  *C15 C 0 1 N N S 0.724   7.679   6.100  1.909  -1.390 -8.853  "CF'"  BIZ 44 
BIZ "CG'"  *C16 C 0 1 Y N N 0.949   8.167   7.494  1.636  -0.483 -10.033 "CG'"  BIZ 45 
BIZ "CH'"  *C17 C 0 1 Y N N -0.085  7.644   8.255  0.614  0.380  -9.699  "CH'"  BIZ 46 
BIZ "CI'"  *C18 C 0 1 N N N 0.470   8.794   5.125  1.658  -2.851 -9.230  "CI'"  BIZ 47 
BIZ "CJ'"  *C19 C 0 1 Y N N -0.181  7.964   9.594  0.178  1.325  -10.638 "CJ'"  BIZ 48 
BIZ "CK'"  *C20 C 0 1 Y N N 0.723   8.798   10.224 0.755  1.401  -11.888 "CK'"  BIZ 49 
BIZ "OL'"  *O21 O 0 1 N N N 0.656   9.143   11.492 0.316  2.325  -12.783 "OL'"  BIZ 50 
BIZ "CM'"  *C22 C 0 1 Y N N 1.801   9.302   9.366  1.789  0.532  -12.234 "CM'"  BIZ 51 
BIZ "CN'"  *C23 C 0 1 Y N N 1.936   8.995   8.007  2.227  -0.419 -11.299 "CN'"  BIZ 52 
BIZ "CO'"  *C24 C 0 1 Y N N 3.139   9.629   7.520  3.306  -1.163 -11.953 "CO'"  BIZ 53 
BIZ "CP'"  *C25 C 0 1 Y N N 3.619   10.317  8.549  3.447  -0.650 -13.185 "CP'"  BIZ 54 
BIZ "CQ'"  *C26 C 0 1 N N N 3.810   9.530   6.217  4.105  -2.294 -11.356 "CQ'"  BIZ 55 
BIZ "NR'"  *N27 N 0 1 Y N N 2.837   10.133  9.650  2.549  0.363  -13.373 "NR'"  BIZ 56 
BIZ HN1    HN1  H 0 1 N N N -5.520  0.346   1.451  -5.034 0.094  1.099   HN1    BIZ 57 
BIZ H3     H3   H 0 1 N N N -5.198  -1.618  0.630  -1.740 0.925  2.011   H3     BIZ 58 
BIZ H6     H6   H 0 1 N N N -10.092 -2.400  0.959  -4.356 -1.295 5.582   H6     BIZ 59 
BIZ H7     H7   H 0 1 N N N -9.092  -0.296  1.821  -5.255 -1.131 3.308   H7     BIZ 60 
BIZ HN8    HN8  H 0 1 N N N -9.313  -4.834  -0.349 -2.045 -0.578 7.122   HN8    BIZ 61 
BIZ H10    H10  H 0 1 N N N -5.156  -4.462  -0.523 0.225  1.321  4.178   H10    BIZ 62 
BIZ H141   1H14 H 0 0 N N N -4.532  -6.020  -1.679 -0.884 -1.465 8.193   H141   BIZ 63 
BIZ H142   2H14 H 0 0 N N N -4.951  -6.810  -0.264 -1.685 0.059  8.679   H142   BIZ 64 
BIZ H15    H15  H 0 1 N N N -3.285  -7.902  -1.952 -1.166 -0.367 10.875  H15    BIZ 65 
BIZ H181   1H18 H 0 0 N N N -3.355  -10.301 -1.404 0.190  -2.798 9.631   H181   BIZ 66 
BIZ H182   2H18 H 0 0 N N N -3.194  -8.946  -0.263 0.199  -2.512 11.388  H182   BIZ 67 
BIZ H183   3H18 H 0 0 N N N -4.748  -9.730  -0.457 -1.344 -2.739 10.531  H183   BIZ 68 
BIZ H19    H19  H 0 1 N N N -8.284  -7.483  -3.755 2.863  1.537  8.243   H19    BIZ 69 
BIZ HO2    HO2  H 0 1 N N N -7.989  -9.541  -6.700 4.395  2.731  10.426  HO2    BIZ 70 
BIZ H25    H25  H 0 1 N N N -3.483  -11.360 -6.387 2.965  -0.435 14.605  H25    BIZ 71 
BIZ H261   1H26 H 0 0 N N N -1.447  -10.738 -4.556 -0.191 -0.707 14.016  H261   BIZ 72 
BIZ H262   2H26 H 0 0 N N N -1.993  -9.105  -4.153 -0.050 -1.884 12.689  H262   BIZ 73 
BIZ H263   3H26 H 0 0 N N N -2.401  -10.452 -3.095 0.868  -2.126 14.194  H263   BIZ 74 
BIZ HN7    HN7  H 0 1 N N N -5.958  -10.710 -6.822 4.428  0.853  12.966  HN7    BIZ 75 
BIZ "HN1'" *HN1 H 0 0 N N N -5.228  2.076   2.251  -4.673 0.399  -1.197  "HN1'" BIZ 76 
BIZ "H3'"  *H3  H 0 1 N N N -3.298  2.829   3.731  -3.919 1.430  -3.365  "H3'"  BIZ 77 
BIZ "H6'"  *H6  H 0 1 N N N -6.650  3.819   7.195  -0.310 -1.956 -3.205  "H6'"  BIZ 78 
BIZ "H7'"  *H7  H 0 1 N N N -7.244  2.465   5.171  -1.764 -1.603 -1.264  "H7'"  BIZ 79 
BIZ "HN8'" *HN8 H 0 0 N N N -4.468  5.286   8.291  0.118  -0.993 -5.872  "HN8'" BIZ 80 
BIZ "H10'" *H10 H 0 0 N N N -1.510  4.519   5.505  -2.890 1.892  -6.093  "H10'" BIZ 81 
BIZ "H4'1" 1H4* H 0 0 N N N 0.126   5.564   6.154  1.441  -0.581 -6.893  "H4'1" BIZ 82 
BIZ "H4'2" 2H4* H 0 0 N N N -1.027  6.538   5.420  0.238  -1.752 -7.514  "H4'2" BIZ 83 
BIZ "H15'" *H15 H 0 0 N N N 1.615   7.239   5.595  2.932  -1.259 -8.502  "H15'" BIZ 84 
BIZ "H8'1" 1H8* H 0 0 N N N 1.229   9.600   5.000  2.133  -3.502 -8.497  "H8'1" BIZ 85 
BIZ "H8'2" 2H8* H 0 0 N N N 0.256   8.349   4.125  0.585  -3.043 -9.246  "H8'2" BIZ 86 
BIZ "H8'3" 3H8* H 0 0 N N N -0.510  9.264   5.371  2.076  -3.049 -10.217 "H8'3" BIZ 87 
BIZ "H19'" *H19 H 0 0 N N N -1.010  7.537   10.182 -0.622 2.002  -10.380 "H19'" BIZ 88 
BIZ "HO2'" *HO2 H 0 0 N N N 1.277   9.716   11.925 0.845  3.123  -12.644 "HO2'" BIZ 89 
BIZ "H25'" *H25 H 0 0 N N N 4.525   10.943  8.497  4.162  -0.989 -13.920 "H25'" BIZ 90 
BIZ "H6'1" 1H6* H 0 0 N N N 4.738   10.019  5.841  4.937  -1.887 -10.782 "H6'1" BIZ 91 
BIZ "H6'2" 2H6* H 0 0 N N N 3.979   8.438   6.064  3.465  -2.884 -10.700 "H6'2" BIZ 92 
BIZ "H6'3" 3H6* H 0 0 N N N 3.025   9.792   5.469  4.489  -2.928 -12.155 "H6'3" BIZ 93 
BIZ "HN7'" *HN7 H 0 0 N N N 3.004   10.558  10.561 2.460  0.886  -14.185 "HN7'" BIZ 94 
# 
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 
BIZ C     O      DOUB N N 1   
BIZ C     N1     SING N N 2   
BIZ C     "N1'"  SING N N 3   
BIZ N1    C2     SING N N 4   
BIZ N1    HN1    SING N N 5   
BIZ C2    C3     DOUB Y N 6   
BIZ C2    C7     SING Y N 7   
BIZ C3    C4     SING Y N 8   
BIZ C3    H3     SING N N 9   
BIZ C4    C5     DOUB Y N 10  
BIZ C4    C10    SING Y N 11  
BIZ C5    C6     SING Y N 12  
BIZ C5    N8     SING Y N 13  
BIZ C6    C7     DOUB Y N 14  
BIZ C6    H6     SING N N 15  
BIZ C7    H7     SING N N 16  
BIZ N8    C9     SING Y N 17  
BIZ N8    HN8    SING N N 18  
BIZ C9    C10    DOUB Y N 19  
BIZ C9    C11    SING N N 20  
BIZ C10   H10    SING N N 21  
BIZ C11   O12    DOUB N N 22  
BIZ C11   N13    SING N N 23  
BIZ N13   C14    SING N N 24  
BIZ N13   C17    SING N N 25  
BIZ C14   C15    SING N N 26  
BIZ C14   H141   SING N N 27  
BIZ C14   H142   SING N N 28  
BIZ C15   C16    SING N N 29  
BIZ C15   C18    SING N N 30  
BIZ C15   H15    SING N N 31  
BIZ C16   C17    DOUB Y N 32  
BIZ C16   C23    SING Y N 33  
BIZ C17   C19    SING Y N 34  
BIZ C18   H181   SING N N 35  
BIZ C18   H182   SING N N 36  
BIZ C18   H183   SING N N 37  
BIZ C19   C20    DOUB Y N 38  
BIZ C19   H19    SING N N 39  
BIZ C20   O21    SING N N 40  
BIZ C20   C22    SING Y N 41  
BIZ O21   HO2    SING N N 42  
BIZ C22   C23    DOUB Y N 43  
BIZ C22   N27    SING Y N 44  
BIZ C23   C24    SING Y N 45  
BIZ C24   C25    DOUB Y N 46  
BIZ C24   C26    SING N N 47  
BIZ C25   N27    SING Y N 48  
BIZ C25   H25    SING N N 49  
BIZ C26   H261   SING N N 50  
BIZ C26   H262   SING N N 51  
BIZ C26   H263   SING N N 52  
BIZ N27   HN7    SING N N 53  
BIZ "N1'" "C2'"  SING N N 54  
BIZ "N1'" "HN1'" SING N N 55  
BIZ "C2'" "C3'"  DOUB Y N 56  
BIZ "C2'" "C7'"  SING Y N 57  
BIZ "C3'" "C4'"  SING Y N 58  
BIZ "C3'" "H3'"  SING N N 59  
BIZ "C4'" "C5'"  DOUB Y N 60  
BIZ "C4'" "CA'"  SING Y N 61  
BIZ "C5'" "C6'"  SING Y N 62  
BIZ "C5'" "N8'"  SING Y N 63  
BIZ "C6'" "C7'"  DOUB Y N 64  
BIZ "C6'" "H6'"  SING N N 65  
BIZ "C7'" "H7'"  SING N N 66  
BIZ "N8'" "C9'"  SING Y N 67  
BIZ "N8'" "HN8'" SING N N 68  
BIZ "C9'" "CA'"  DOUB Y N 69  
BIZ "C9'" "CB'"  SING N N 70  
BIZ "CA'" "H10'" SING N N 71  
BIZ "CB'" "OC'"  DOUB N N 72  
BIZ "CB'" "ND'"  SING N N 73  
BIZ "ND'" "CE'"  SING N N 74  
BIZ "ND'" "CH'"  SING N N 75  
BIZ "CE'" "CF'"  SING N N 76  
BIZ "CE'" "H4'1" SING N N 77  
BIZ "CE'" "H4'2" SING N N 78  
BIZ "CF'" "CG'"  SING N N 79  
BIZ "CF'" "CI'"  SING N N 80  
BIZ "CF'" "H15'" SING N N 81  
BIZ "CG'" "CH'"  DOUB Y N 82  
BIZ "CG'" "CN'"  SING Y N 83  
BIZ "CH'" "CJ'"  SING Y N 84  
BIZ "CI'" "H8'1" SING N N 85  
BIZ "CI'" "H8'2" SING N N 86  
BIZ "CI'" "H8'3" SING N N 87  
BIZ "CJ'" "CK'"  DOUB Y N 88  
BIZ "CJ'" "H19'" SING N N 89  
BIZ "CK'" "OL'"  SING N N 90  
BIZ "CK'" "CM'"  SING Y N 91  
BIZ "OL'" "HO2'" SING N N 92  
BIZ "CM'" "CN'"  DOUB Y N 93  
BIZ "CM'" "NR'"  SING Y N 94  
BIZ "CN'" "CO'"  SING Y N 95  
BIZ "CO'" "CP'"  DOUB Y N 96  
BIZ "CO'" "CQ'"  SING N N 97  
BIZ "CP'" "NR'"  SING Y N 98  
BIZ "CP'" "H25'" SING N N 99  
BIZ "CQ'" "H6'1" SING N N 100 
BIZ "CQ'" "H6'2" SING N N 101 
BIZ "CQ'" "H6'3" SING N N 102 
BIZ "NR'" "HN7'" SING N N 103 
# 
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 
BIZ SMILES           ACDLabs              10.04 O=C(N3c2cc(O)c1c(c(cn1)C)c2C(C)C3)c5cc4cc(ccc4n5)NC(=O)Nc6cc7cc(nc7cc6)C(=O)N%10c9cc(O)c8c(c(cn8)C)c9C(C)C%10 
BIZ InChI            InChI                1.02b 
;InChI=1/C43H38N8O5/c1-19-15-44-39-33(52)13-31-35(37(19)39)21(3)17-50(31)41(54)29-11-23-9-25(5-7-27(23)48-29)46-43(56)47-26-6-8-28-24(10-26)12-30(49-28)42(55)51-18-22(4)36-32(51)14-34(53)40-38(36)20(2)16-45-40/h5-16,21-22,44-45,48-49,52-53H,17-18H2,1-4H3,(H2,46,47,56)/t21-,22-/m1/s1/f/h46-47H
;
BIZ InChIKey         InChI                1.02b OAOMXBKMJIBOHZ-URMZFDFLDS 
BIZ SMILES_CANONICAL CACTVS               3.341 C[C@@H]1CN(C(=O)c2[nH]c3ccc(NC(=O)Nc4ccc5[nH]c(cc5c4)C(=O)N6C[C@@H](C)c7c6cc(O)c8[nH]cc(C)c78)cc3c2)c9cc(O)c%10[nH]cc(C)c%10c19 
BIZ SMILES           CACTVS               3.341 C[CH]1CN(C(=O)c2[nH]c3ccc(NC(=O)Nc4ccc5[nH]c(cc5c4)C(=O)N6C[CH](C)c7c6cc(O)c8[nH]cc(C)c78)cc3c2)c9cc(O)c%10[nH]cc(C)c%10c19 
BIZ SMILES_CANONICAL "OpenEye OEToolkits" 1.5.0 Cc1c[nH]c2c1c3c(cc2O)N(C[C@H]3C)C(=O)c4cc5cc(ccc5[nH]4)NC(=O)Nc6ccc7c(c6)cc([nH]7)C(=O)N8C[C@H](c9c8cc(c1c9c(c[nH]1)C)O)C 
BIZ SMILES           "OpenEye OEToolkits" 1.5.0 Cc1c[nH]c2c1c3c(cc2O)N(CC3C)C(=O)c4cc5cc(ccc5[nH]4)NC(=O)Nc6ccc7c(c6)cc([nH]7)C(=O)N8CC(c9c8cc(c1c9c(c[nH]1)C)O)C 
# 
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 
BIZ "SYSTEMATIC NAME" ACDLabs              10.04 1,3-bis(2-{[(1S)-5-hydroxy-1,8-dimethyl-1,6-dihydropyrrolo[3,2-e]indol-3(2H)-yl]carbonyl}-1H-indol-5-yl)urea 
BIZ "SYSTEMATIC NAME" "OpenEye OEToolkits" 1.5.0 1,3-bis[2-[[(8S)-4-hydroxy-1,8-dimethyl-7,8-dihydro-3H-pyrrolo[3,2-e]indol-6-yl]carbonyl]-1H-indol-5-yl]urea 
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