# 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 MDA MDA '2,6-DIDEOXY-3 C-METHYL-D-RIBOPYRANOS' non-polymer 25 11 M # data_comp_MDA # 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 MDA C1 C . 0.000 MDA C2 C . 0.000 MDA C3 C . 0.000 MDA C4 C . 0.000 MDA C5 C . 0.000 MDA C6 C . 0.000 MDA 'C3'' C . 0.000 MDA O1 O . 0.000 MDA O5 O . 0.000 MDA O3 O . 0.000 MDA O4 O . 0.000 MDA H1 H . 0.000 MDA H21 H . 0.000 MDA H22 H . 0.000 MDA H4 H . 0.000 MDA H5 H . 0.000 MDA H61 H . 0.000 MDA H62 H . 0.000 MDA H63 H . 0.000 MDA 'H3'1' H . 0.000 MDA 'H3'2' H . 0.000 MDA 'H3'3' H . 0.000 MDA HO1 H . 0.000 MDA HO3 H . 0.000 MDA HO4 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 MDA C1 C2 single MDA C1 O5 single MDA C1 O1 single MDA C1 H1 single MDA C2 C3 single MDA C2 H21 single MDA C2 H22 single MDA C3 C4 single MDA C3 O3 single MDA C3 'C3'' single MDA C4 C5 single MDA C4 O4 single MDA C4 H4 single MDA C5 C6 single MDA C5 O5 single MDA C5 H5 single MDA C6 H61 single MDA C6 H62 single MDA C6 H63 single MDA 'C3'' 'H3'1' single MDA 'C3'' 'H3'2' single MDA 'C3'' 'H3'3' single MDA O1 HO1 single MDA O3 HO3 single MDA O4 HO4 single