# 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 APR APR 'ADENOSINE-5-DIPHOSPHORIBOSE ' non-polymer 59 36 M # data_comp_APR # 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 APR N1 N . 0.000 APR C2 C . 0.000 APR N3 N . 0.000 APR C4 C . 0.000 APR C5 C . 0.000 APR C6 C . 0.000 APR N6 N . 0.000 APR N7 N . 0.000 APR C8 C . 0.000 APR N9 N . 0.000 APR C1* C . 0.000 APR C2* C . 0.000 APR O2* O . 0.000 APR C3* C . 0.000 APR O3* O . 0.000 APR O4* O . 0.000 APR C4* C . 0.000 APR C5* C . 0.000 APR O5* O . 0.000 APR PA P . 0.000 APR O1A O . 0.000 APR O2A O . 0.000 APR O3A O . 0.000 APR PB P . 0.000 APR O1B O . 0.000 APR O2B O . 0.000 APR RO5* O . 0.000 APR RC5* C . 0.000 APR RO4* O . 0.000 APR RO1* O . 0.000 APR RC1* C . 0.000 APR RO2* O . 0.000 APR RC2* C . 0.000 APR RO3* O . 0.000 APR RC3* C . 0.000 APR RC4* C . 0.000 APR H2 H . 0.000 APR H61 H . 0.000 APR H62 H . 0.000 APR H8 H . 0.000 APR H*1 H . 0.000 APR H*2 H . 0.000 APR HO*2 H . 0.000 APR H*3 H . 0.000 APR HO*3 H . 0.000 APR H*4 H . 0.000 APR H5*1 H . 0.000 APR H5*2 H . 0.000 APR HOA2 H . 0.000 APR HOB2 H . 0.000 APR H5R1 H . 0.000 APR H5R2 H . 0.000 APR HOR1 H . 0.000 APR HR*1 H . 0.000 APR HOR2 H . 0.000 APR HR*2 H . 0.000 APR HOR3 H . 0.000 APR HR*3 H . 0.000 APR HR*4 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 APR N1 C2 single APR N1 C6 double APR C2 N3 double APR C2 H2 single APR N3 C4 single APR C4 C5 double APR C4 N9 single APR C5 C6 single APR C5 N7 single APR C6 N6 single APR N6 H61 single APR N6 H62 single APR N7 C8 double APR C8 N9 single APR C8 H8 single APR N9 C1* single APR C1* C2* single APR C1* O4* single APR C1* H*1 single APR C2* O2* single APR C2* C3* single APR C2* H*2 single APR O2* HO*2 single APR C3* O3* single APR C3* C4* single APR C3* H*3 single APR O3* HO*3 single APR O4* C4* single APR C4* C5* single APR C4* H*4 single APR C5* O5* single APR C5* H5*1 single APR C5* H5*2 single APR O5* PA single APR PA O1A double APR PA O2A single APR PA O3A single APR O2A HOA2 single APR O3A PB single APR PB O1B double APR PB O2B single APR PB RO5* single APR O2B HOB2 single APR RO5* RC5* single APR RC5* RC4* single APR RC5* H5R1 single APR RC5* H5R2 single APR RO4* RC1* single APR RO4* RC4* single APR RO1* RC1* single APR RO1* HOR1 single APR RC1* RC2* single APR RC1* HR*1 single APR RO2* RC2* single APR RO2* HOR2 single APR RC2* RC3* single APR RC2* HR*2 single APR RO3* RC3* single APR RO3* HOR3 single APR RC3* RC4* single APR RC3* HR*3 single APR RC4* HR*4 single