# data_comp_list loop_ _chem_comp.id _chem_comp.three_letter_code _chem_comp.name _chem_comp.group _chem_comp.number_atoms_all _chem_comp.number_atoms_nh _chem_comp.desc_level SSA SSA '5"-O-(N-(L-SERYL)-SULFAMOYL)ADENOSIN' non-polymer 48 29 M # data_comp_SSA # loop_ _chem_comp_atom.comp_id _chem_comp_atom.atom_id _chem_comp_atom.type_symbol _chem_comp_atom.type_energy _chem_comp_atom.partial_charge SSA N10 N . 0.000 SSA CA C . 0.000 SSA CB C . 0.000 SSA OG O . 0.000 SSA C9 C . 0.000 SSA O9 O . 0.000 SSA N8 N . 0.000 SSA S1 S . 0.000 SSA O1S O . 0.000 SSA O2S O . 0.000 SSA O5* O . 0.000 SSA C5* C . 0.000 SSA C4* C . 0.000 SSA O4* O . 0.000 SSA C3* C . 0.000 SSA O3* O . 0.000 SSA C2* C . 0.000 SSA O2* O . 0.000 SSA C1* C . 0.000 SSA N9 N . 0.000 SSA C8 C . 0.000 SSA N7 N . 0.000 SSA C5 C . 0.000 SSA C6 C . 0.000 SSA N6 N . 0.000 SSA N1 N . 0.000 SSA C2 C . 0.000 SSA N3 N . 0.000 SSA C4 C . 0.000 SSA H2 H . 0.000 SSA H8 H . 0.000 SSA HN61 H . 0.000 SSA HN62 H . 0.000 SSA H1* H . 0.000 SSA H2* H . 0.000 SSA HO2* H . 0.000 SSA H3* H . 0.000 SSA HO3* H . 0.000 SSA H4* H . 0.000 SSA H5*1 H . 0.000 SSA H5*2 H . 0.000 SSA HN8 H . 0.000 SSA HA H . 0.000 SSA HB1 H . 0.000 SSA HB2 H . 0.000 SSA HOG H . 0.000 SSA HN11 H . 0.000 SSA HN12 H . 0.000 loop_ _chem_comp_bond.comp_id _chem_comp_bond.atom_id_1 _chem_comp_bond.atom_id_2 _chem_comp_bond.type SSA N10 CA single SSA N10 HN11 single SSA N10 HN12 single SSA CA CB single SSA CA C9 single SSA CA HA single SSA CB OG single SSA CB HB1 single SSA CB HB2 single SSA OG HOG single SSA C9 O9 double SSA C9 N8 single SSA N8 S1 single SSA N8 HN8 single SSA S1 O1S double SSA S1 O2S double SSA S1 O5* single SSA O5* C5* single SSA C5* C4* single SSA C5* H5*1 single SSA C5* H5*2 single SSA C4* O4* single SSA C4* C3* single SSA C4* H4* single SSA O4* C1* single SSA C3* O3* single SSA C3* C2* single SSA C3* H3* single SSA O3* HO3* single SSA C2* O2* single SSA C2* C1* single SSA C2* H2* single SSA O2* HO2* single SSA C1* N9 single SSA C1* H1* single SSA N9 C8 single SSA N9 C4 single SSA C8 N7 double SSA C8 H8 single SSA N7 C5 single SSA C5 C6 single SSA C5 C4 double SSA C6 N6 single SSA C6 N1 double SSA N6 HN61 single SSA N6 HN62 single SSA N1 C2 single SSA C2 N3 double SSA C2 H2 single SSA N3 C4 single