# 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 OC5 OC5 'CALCIUM ION, 5 WATERS COORDINATED ' non-polymer 16 6 M # data_comp_OC5 # 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 OC5 CA CA . 2.000 OC5 O1 O . 0.000 OC5 O2 O . 0.000 OC5 O3 O . 0.000 OC5 O4 O . 0.000 OC5 O5 O . 0.000 OC5 HO11 H . 0.000 OC5 HO12 H . 0.000 OC5 HO21 H . 0.000 OC5 HO22 H . 0.000 OC5 HO31 H . 0.000 OC5 HO32 H . 0.000 OC5 HO41 H . 0.000 OC5 HO42 H . 0.000 OC5 HO51 H . 0.000 OC5 HO52 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 OC5 CA O1 single OC5 CA O2 single OC5 CA O3 single OC5 CA O4 single OC5 CA O5 single OC5 O1 HO11 single OC5 O1 HO12 single OC5 O2 HO21 single OC5 O2 HO22 single OC5 O3 HO31 single OC5 O3 HO32 single OC5 O4 HO41 single OC5 O4 HO42 single OC5 O5 HO51 single OC5 O5 HO52 single