data_49X # _chem_comp.id 49X _chem_comp.name "(1R)-1,5-anhydro-1-{(1E,3S,4S,5R)-4,5-dihydroxy-3-[(8-phenyloctanoyl)amino]nonadec-1-en-1-yl}-D-galactitol" _chem_comp.type NON-POLYMER _chem_comp.pdbx_type HETAIN _chem_comp.formula "C39 H67 N O8" _chem_comp.mon_nstd_parent_comp_id ? _chem_comp.pdbx_synonyms GCK152 _chem_comp.pdbx_formal_charge 0 _chem_comp.pdbx_initial_date 2015-02-18 _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 677.951 _chem_comp.one_letter_code ? _chem_comp.three_letter_code 49X _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 4Y4H _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 49X C1 C1 C 0 1 N N R 3.423 -1.305 18.782 1.232 3.343 0.787 C1 49X 1 49X CBB C2 C 0 1 N N N 15.199 10.291 15.675 -19.610 -1.392 0.715 CBB 49X 2 49X CBA C3 C 0 1 N N N 15.289 9.582 17.043 -18.378 -1.575 -0.175 CBA 49X 3 49X CAZ C4 C 0 1 N N N 14.309 10.202 18.054 -17.115 -1.273 0.634 CAZ 49X 4 49X CAY C5 C 0 1 N N N 14.637 9.800 19.492 -15.884 -1.455 -0.256 CAY 49X 5 49X CAX C6 C 0 1 N N N 13.362 9.330 20.179 -14.621 -1.153 0.553 CAX 49X 6 49X CAW C7 C 0 1 N N N 13.583 8.032 20.933 -13.389 -1.335 -0.336 CAW 49X 7 49X CAV C8 C 0 1 N N N 12.930 8.154 22.292 -12.127 -1.033 0.473 CAV 49X 8 49X CAU C9 C 0 1 N N N 12.427 6.800 22.749 -10.895 -1.216 -0.417 CAU 49X 9 49X CAT C10 C 0 1 N N N 12.863 5.679 21.801 -9.632 -0.914 0.392 CAT 49X 10 49X CAS C11 C 0 1 N N N 12.384 4.315 22.324 -8.401 -1.096 -0.498 CAS 49X 11 49X CAR C12 C 0 1 N N N 10.934 4.384 22.834 -7.138 -0.794 0.311 CAR 49X 12 49X CAQ C13 C 0 1 N N N 10.288 3.004 22.916 -5.907 -0.976 -0.578 CAQ 49X 13 49X CAP C14 C 0 1 N N N 9.893 2.541 21.528 -4.644 -0.674 0.231 CAP 49X 14 49X CAO C15 C 0 1 N N N 8.451 2.080 21.503 -3.412 -0.857 -0.659 CAO 49X 15 49X CAN C16 C 0 1 N N R 8.041 1.976 20.039 -2.149 -0.555 0.150 CAN 49X 16 49X OBN O1 O 0 1 N N N 9.056 1.360 19.242 -2.009 -1.522 1.193 OBN 49X 17 49X CAM C17 C 0 1 N N S 6.793 1.175 19.817 -0.928 -0.615 -0.769 CAM 49X 18 49X OBL O2 O 0 1 N N N 6.668 1.236 18.411 -1.068 0.352 -1.812 OBL 49X 19 49X CAL C18 C 0 1 N N S 6.870 -0.309 20.268 0.335 -0.313 0.040 CAL 49X 20 49X CAK C19 C 0 1 N N N 5.799 -1.162 19.546 0.283 1.107 0.540 CAK 49X 21 49X CAH C20 C 0 1 N N N 4.481 -0.686 19.476 1.215 1.959 0.191 CAH 49X 22 49X OG O3 O 0 1 N N N 3.257 -2.732 18.963 2.407 3.505 1.584 OG 49X 23 49X CG C21 C 0 1 N N R 3.158 -2.987 20.392 3.629 3.318 0.866 CG 49X 24 49X CG5 C22 C 0 1 N N N 3.455 -4.457 20.639 4.812 3.487 1.821 CG5 49X 25 49X OG6 O4 O 0 1 N N N 2.689 -4.811 21.755 4.786 2.447 2.800 OG6 49X 26 49X CG4 C23 C 0 1 N N R 1.836 -2.393 20.960 3.725 4.357 -0.255 CG4 49X 27 49X OG5 O5 O 0 1 N N N 0.709 -3.113 20.459 3.754 5.668 0.311 OG5 49X 28 49X CG3 C24 C 0 1 N N R 1.710 -0.895 20.632 2.506 4.221 -1.172 CG3 49X 29 49X OG4 O6 O 0 1 N N N 0.374 -0.490 20.941 2.549 5.234 -2.179 OG4 49X 30 49X CG2 C25 C 0 1 N N R 2.092 -0.606 19.154 1.232 4.383 -0.337 CG2 49X 31 49X OG3 O7 O 0 1 N N N 2.210 0.797 18.850 0.087 4.186 -1.169 OG3 49X 32 49X NBC N1 N 0 1 N N N 6.681 -0.391 21.721 1.514 -0.488 -0.812 NBC 49X 33 49X CBD C26 C 0 1 N N N 6.961 -1.498 22.405 2.709 -0.776 -0.259 CBD 49X 34 49X OBM O8 O 0 1 N N N 7.341 -2.558 21.893 2.808 -0.890 0.945 OBM 49X 35 49X CBE C27 C 0 1 N N N 6.742 -1.382 23.910 3.921 -0.956 -1.135 CBE 49X 36 49X CBF C28 C 0 1 N N N 7.928 -1.949 24.676 5.138 -1.273 -0.263 CBF 49X 37 49X CBG C29 C 0 1 N N N 8.300 -1.034 25.859 6.369 -1.456 -1.153 CBG 49X 38 49X CBH C30 C 0 1 N N N 9.614 -0.286 25.598 7.586 -1.773 -0.281 CBH 49X 39 49X CBI C31 C 0 1 N N N 10.560 -0.286 26.803 8.817 -1.955 -1.171 CBI 49X 40 49X CBJ C32 C 0 1 N N N 11.988 0.025 26.370 10.034 -2.273 -0.299 CBJ 49X 41 49X CBK C33 C 0 1 N N N 12.780 0.765 27.449 11.265 -2.455 -1.188 CBK 49X 42 49X CBO C34 C 0 1 Y N N 14.219 0.206 27.604 12.463 -2.768 -0.329 CBO 49X 43 49X CBR C35 C 0 1 Y N N 14.629 -0.972 26.958 13.249 -1.742 0.161 CBR 49X 44 49X CBS C36 C 0 1 Y N N 15.929 -1.473 27.111 14.348 -2.028 0.948 CBS 49X 45 49X CBT C37 C 0 1 Y N N 16.835 -0.788 27.914 14.661 -3.341 1.246 CBT 49X 46 49X CBU C38 C 0 1 Y N N 16.438 0.385 28.559 13.875 -4.368 0.757 CBU 49X 47 49X CBV C39 C 0 1 Y N N 15.142 0.881 28.407 12.774 -4.081 -0.027 CBV 49X 48 49X H1 H1 H 0 1 N N N 3.574 -1.126 17.707 0.348 3.482 1.410 H1 49X 49 49X H2 H2 H 0 1 N N N 15.909 9.828 14.974 -20.509 -1.607 0.138 H2 49X 50 49X H3 H3 H 0 1 N N N 14.177 10.195 15.279 -19.549 -2.074 1.562 H3 49X 51 49X H4 H4 H 0 1 N N N 15.446 11.356 15.797 -19.647 -0.365 1.077 H4 49X 52 49X H5 H5 H 0 1 N N N 15.045 8.517 16.913 -18.341 -2.602 -0.537 H5 49X 53 49X H6 H6 H 0 1 N N N 16.314 9.678 17.431 -18.438 -0.892 -1.023 H6 49X 54 49X H7 H7 H 0 1 N N N 14.360 11.298 17.971 -17.153 -0.245 0.996 H7 49X 55 49X H8 H8 H 0 1 N N N 13.290 9.863 17.814 -17.055 -1.955 1.482 H8 49X 56 49X H9 H9 H 0 1 N N N 15.375 8.985 19.488 -15.846 -2.482 -0.618 H9 49X 57 49X H10 H10 H 0 1 N N N 15.049 10.665 20.032 -15.944 -0.773 -1.104 H10 49X 58 49X H11 H11 H 0 1 N N N 13.032 10.104 20.888 -14.658 -0.125 0.915 H11 49X 59 49X H12 H12 H 0 1 N N N 12.583 9.173 19.418 -14.561 -1.835 1.401 H12 49X 60 49X H13 H13 H 0 1 N N N 13.131 7.197 20.377 -13.352 -2.363 -0.698 H13 49X 61 49X H14 H14 H 0 1 N N N 14.661 7.851 21.054 -13.450 -0.653 -1.184 H14 49X 62 49X H15 H15 H 0 1 N N N 13.666 8.533 23.017 -12.164 -0.006 0.835 H15 49X 63 49X H16 H16 H 0 1 N N N 12.084 8.854 22.228 -12.066 -1.715 1.321 H16 49X 64 49X H17 H17 H 0 1 N N N 11.328 6.824 22.790 -10.858 -2.243 -0.779 H17 49X 65 49X H18 H18 H 0 1 N N N 12.827 6.592 23.753 -10.955 -0.534 -1.265 H18 49X 66 49X H19 H19 H 0 1 N N N 13.961 5.673 21.728 -9.670 0.114 0.754 H19 49X 67 49X H20 H20 H 0 1 N N N 12.430 5.858 20.806 -9.572 -1.596 1.240 H20 49X 68 49X H21 H21 H 0 1 N N N 12.441 3.579 21.508 -8.363 -2.123 -0.860 H21 49X 69 49X H22 H22 H 0 1 N N N 13.039 3.999 23.150 -8.461 -0.414 -1.346 H22 49X 70 49X H23 H23 H 0 1 N N N 10.932 4.837 23.836 -7.175 0.234 0.674 H23 49X 71 49X H24 H24 H 0 1 N N N 10.346 5.011 22.147 -7.078 -1.476 1.159 H24 49X 72 49X H25 H25 H 0 1 N N N 9.392 3.057 23.552 -5.869 -2.004 -0.940 H25 49X 73 49X H26 H26 H 0 1 N N N 11.004 2.290 23.349 -5.967 -0.294 -1.426 H26 49X 74 49X H27 H27 H 0 1 N N N 10.543 1.706 21.228 -4.681 0.353 0.593 H27 49X 75 49X H28 H28 H 0 1 N N N 10.017 3.375 20.821 -4.583 -1.356 1.079 H28 49X 76 49X H29 H29 H 0 1 N N N 7.812 2.809 22.023 -3.375 -1.884 -1.021 H29 49X 77 49X H30 H30 H 0 1 N N N 8.360 1.099 21.991 -3.472 -0.175 -1.507 H30 49X 78 49X H31 H31 H 0 1 N N N 7.863 2.996 19.667 -2.227 0.441 0.586 H31 49X 79 49X H32 H32 H 0 1 N N N 9.873 1.833 19.348 -1.934 -2.432 0.877 H32 49X 80 49X H33 H33 H 0 1 N N N 5.941 1.661 20.314 -0.851 -1.611 -1.205 H33 49X 81 49X H34 H34 H 0 1 N N N 5.896 0.754 18.140 -1.143 1.263 -1.497 H34 49X 82 49X H35 H35 H 0 1 N N N 7.863 -0.701 20.004 0.395 -0.995 0.888 H35 49X 83 49X H36 H36 H 0 1 N N N 6.063 -2.111 19.102 -0.522 1.423 1.187 H36 49X 84 49X H37 H37 H 0 1 N N N 4.259 0.233 19.998 1.972 1.670 -0.523 H37 49X 85 49X H38 H38 H 0 1 N N N 3.971 -2.425 20.875 3.648 2.316 0.437 H38 49X 86 49X H39 H39 H 0 1 N N N 3.164 -5.060 19.766 5.744 3.432 1.258 H39 49X 87 49X H40 H40 H 0 1 N N N 4.525 -4.603 20.845 4.744 4.455 2.317 H40 49X 88 49X H41 H41 H 0 1 N N N 2.833 -5.727 21.961 5.509 2.491 3.441 H41 49X 89 49X H42 H42 H 0 1 N N N 1.871 -2.494 22.055 4.635 4.188 -0.831 H42 49X 90 49X H43 H43 H 0 1 N N N -0.089 -2.740 20.814 3.815 6.378 -0.343 H43 49X 91 49X H44 H44 H 0 1 N N N 2.415 -0.347 21.274 2.511 3.238 -1.643 H44 49X 92 49X H45 H45 H 0 1 N N N 0.186 -0.686 21.851 1.806 5.207 -2.796 H45 49X 93 49X H46 H46 H 0 1 N N N 1.304 -1.040 18.521 1.203 5.384 0.093 H46 49X 94 49X H47 H47 H 0 1 N N N 1.399 1.239 19.073 -0.757 4.269 -0.704 H47 49X 95 49X H48 H48 H 0 1 N N N 6.332 0.408 22.211 1.435 -0.396 -1.775 H48 49X 96 49X H49 H49 H 0 1 N N N 6.616 -0.322 24.175 3.749 -1.777 -1.830 H49 49X 97 49X H50 H50 H 0 1 N N N 5.835 -1.940 24.186 4.105 -0.038 -1.694 H50 49X 98 49X H51 H51 H 0 1 N N N 7.667 -2.946 25.059 5.311 -0.452 0.433 H51 49X 99 49X H52 H52 H 0 1 N N N 8.790 -2.031 23.998 4.955 -2.190 0.296 H52 49X 100 49X H53 H53 H 0 1 N N N 7.495 -0.300 26.011 6.197 -2.277 -1.848 H53 49X 101 49X H54 H54 H 0 1 N N N 8.412 -1.648 26.765 6.553 -0.538 -1.712 H54 49X 102 49X H55 H55 H 0 1 N N N 10.127 -0.766 24.751 7.759 -0.952 0.415 H55 49X 103 49X H56 H56 H 0 1 N N N 9.377 0.757 25.340 7.403 -2.690 0.278 H56 49X 104 49X H57 H57 H 0 1 N N N 10.227 0.476 27.523 8.644 -2.777 -1.866 H57 49X 105 49X H58 H58 H 0 1 N N N 10.536 -1.277 27.281 9.000 -1.038 -1.730 H58 49X 106 49X H59 H59 H 0 1 N N N 12.501 -0.921 26.142 10.207 -1.452 0.397 H59 49X 107 49X H60 H60 H 0 1 N N N 11.954 0.651 25.466 9.851 -3.190 0.261 H60 49X 108 49X H61 H61 H 0 1 N N N 12.840 1.829 27.177 11.092 -3.277 -1.884 H61 49X 109 49X H62 H62 H 0 1 N N N 12.254 0.661 28.409 11.448 -1.538 -1.748 H62 49X 110 49X H63 H63 H 0 1 N N N 13.928 -1.503 26.331 13.005 -0.716 -0.072 H63 49X 111 49X H64 H64 H 0 1 N N N 16.225 -2.383 26.610 14.963 -1.227 1.331 H64 49X 112 49X H65 H65 H 0 1 N N N 17.841 -1.162 28.038 15.521 -3.566 1.861 H65 49X 113 49X H66 H66 H 0 1 N N N 17.142 0.915 29.183 14.120 -5.393 0.989 H66 49X 114 49X H67 H67 H 0 1 N N N 14.852 1.790 28.912 12.157 -4.882 -0.407 H67 49X 115 # # 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 49X CBB CBA SING N N 1 49X CBA CAZ SING N N 2 49X CAZ CAY SING N N 3 49X OBL CAM SING N N 4 49X C1 OG SING N N 5 49X C1 CG2 SING N N 6 49X C1 CAH SING N N 7 49X OG3 CG2 SING N N 8 49X OG CG SING N N 9 49X CG2 CG3 SING N N 10 49X OBN CAN SING N N 11 49X CAH CAK DOUB N E 12 49X CAY CAX SING N N 13 49X CAK CAL SING N N 14 49X CAM CAN SING N N 15 49X CAM CAL SING N N 16 49X CAN CAO SING N N 17 49X CAX CAW SING N N 18 49X CAL NBC SING N N 19 49X CG CG5 SING N N 20 49X CG CG4 SING N N 21 49X OG5 CG4 SING N N 22 49X CG3 OG4 SING N N 23 49X CG3 CG4 SING N N 24 49X CG5 OG6 SING N N 25 49X CAW CAV SING N N 26 49X CAO CAP SING N N 27 49X CAP CAQ SING N N 28 49X NBC CBD SING N N 29 49X CAT CAS SING N N 30 49X CAT CAU SING N N 31 49X OBM CBD DOUB N N 32 49X CAV CAU SING N N 33 49X CAS CAR SING N N 34 49X CBD CBE SING N N 35 49X CAR CAQ SING N N 36 49X CBE CBF SING N N 37 49X CBF CBG SING N N 38 49X CBH CBG SING N N 39 49X CBH CBI SING N N 40 49X CBJ CBI SING N N 41 49X CBJ CBK SING N N 42 49X CBR CBS DOUB Y N 43 49X CBR CBO SING Y N 44 49X CBS CBT SING Y N 45 49X CBK CBO SING N N 46 49X CBO CBV DOUB Y N 47 49X CBT CBU DOUB Y N 48 49X CBV CBU SING Y N 49 49X C1 H1 SING N N 50 49X CBB H2 SING N N 51 49X CBB H3 SING N N 52 49X CBB H4 SING N N 53 49X CBA H5 SING N N 54 49X CBA H6 SING N N 55 49X CAZ H7 SING N N 56 49X CAZ H8 SING N N 57 49X CAY H9 SING N N 58 49X CAY H10 SING N N 59 49X CAX H11 SING N N 60 49X CAX H12 SING N N 61 49X CAW H13 SING N N 62 49X CAW H14 SING N N 63 49X CAV H15 SING N N 64 49X CAV H16 SING N N 65 49X CAU H17 SING N N 66 49X CAU H18 SING N N 67 49X CAT H19 SING N N 68 49X CAT H20 SING N N 69 49X CAS H21 SING N N 70 49X CAS H22 SING N N 71 49X CAR H23 SING N N 72 49X CAR H24 SING N N 73 49X CAQ H25 SING N N 74 49X CAQ H26 SING N N 75 49X CAP H27 SING N N 76 49X CAP H28 SING N N 77 49X CAO H29 SING N N 78 49X CAO H30 SING N N 79 49X CAN H31 SING N N 80 49X OBN H32 SING N N 81 49X CAM H33 SING N N 82 49X OBL H34 SING N N 83 49X CAL H35 SING N N 84 49X CAK H36 SING N N 85 49X CAH H37 SING N N 86 49X CG H38 SING N N 87 49X CG5 H39 SING N N 88 49X CG5 H40 SING N N 89 49X OG6 H41 SING N N 90 49X CG4 H42 SING N N 91 49X OG5 H43 SING N N 92 49X CG3 H44 SING N N 93 49X OG4 H45 SING N N 94 49X CG2 H46 SING N N 95 49X OG3 H47 SING N N 96 49X NBC H48 SING N N 97 49X CBE H49 SING N N 98 49X CBE H50 SING N N 99 49X CBF H51 SING N N 100 49X CBF H52 SING N N 101 49X CBG H53 SING N N 102 49X CBG H54 SING N N 103 49X CBH H55 SING N N 104 49X CBH H56 SING N N 105 49X CBI H57 SING N N 106 49X CBI H58 SING N N 107 49X CBJ H59 SING N N 108 49X CBJ H60 SING N N 109 49X CBK H61 SING N N 110 49X CBK H62 SING N N 111 49X CBR H63 SING N N 112 49X CBS H64 SING N N 113 49X CBT H65 SING N N 114 49X CBU H66 SING N N 115 49X CBV H67 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 49X SMILES ACDLabs 12.01 "O=C(NC(/C=C/C1OC(CO)C(O)C(O)C1O)C(O)C(O)CCCCCCCCCCCCCC)CCCCCCCc2ccccc2" 49X InChI InChI 1.03 "InChI=1S/C39H67NO8/c1-2-3-4-5-6-7-8-9-10-11-14-20-25-32(42)36(44)31(27-28-33-37(45)39(47)38(46)34(29-41)48-33)40-35(43)26-21-15-12-13-17-22-30-23-18-16-19-24-30/h16,18-19,23-24,27-28,31-34,36-39,41-42,44-47H,2-15,17,20-22,25-26,29H2,1H3,(H,40,43)/b28-27+/t31-,32+,33+,34+,36-,37-,38-,39+/m0/s1" 49X InChIKey InChI 1.03 RWGUVAAXYHWJFZ-CSYYKWSVSA-N 49X SMILES_CANONICAL CACTVS 3.385 "CCCCCCCCCCCCCC[C@@H](O)[C@@H](O)[C@@H](NC(=O)CCCCCCCc1ccccc1)/C=C/[C@H]2O[C@H](CO)[C@H](O)[C@H](O)[C@H]2O" 49X SMILES CACTVS 3.385 "CCCCCCCCCCCCCC[CH](O)[CH](O)[CH](NC(=O)CCCCCCCc1ccccc1)C=C[CH]2O[CH](CO)[CH](O)[CH](O)[CH]2O" 49X SMILES_CANONICAL "OpenEye OEToolkits" 1.9.2 "CCCCCCCCCCCCCC[C@H]([C@H]([C@H](/C=C/[C@@H]1[C@@H]([C@H]([C@H]([C@H](O1)CO)O)O)O)NC(=O)CCCCCCCc2ccccc2)O)O" 49X SMILES "OpenEye OEToolkits" 1.9.2 "CCCCCCCCCCCCCCC(C(C(C=CC1C(C(C(C(O1)CO)O)O)O)NC(=O)CCCCCCCc2ccccc2)O)O" # # 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 49X "SYSTEMATIC NAME" ACDLabs 12.01 "(1R)-1,5-anhydro-1-{(1E,3S,4S,5R)-4,5-dihydroxy-3-[(8-phenyloctanoyl)amino]nonadec-1-en-1-yl}-D-galactitol" 49X "SYSTEMATIC NAME" "OpenEye OEToolkits" 1.9.2 "N-[(E,3S,4S,5R)-1-[(2R,3R,4R,5R,6R)-6-(hydroxymethyl)-3,4,5-tris(oxidanyl)oxan-2-yl]-4,5-bis(oxidanyl)nonadec-1-en-3-yl]-8-phenyl-octanamide" # # loop_ _pdbx_chem_comp_audit.comp_id _pdbx_chem_comp_audit.action_type _pdbx_chem_comp_audit.date _pdbx_chem_comp_audit.processing_site 49X "Create component" 2015-02-18 RCSB 49X "Initial release" 2015-05-27 RCSB 49X "Modify synonyms" 2021-03-01 PDBE # _pdbx_chem_comp_synonyms.ordinal 1 _pdbx_chem_comp_synonyms.comp_id 49X _pdbx_chem_comp_synonyms.name GCK152 _pdbx_chem_comp_synonyms.provenance ? _pdbx_chem_comp_synonyms.type ? ##