# 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 T5A T5A 'P1-(5"-ADENOSYL)P5-(5"-THYMIDYL)PENT' non-polymer 85 55 M # data_comp_T5A # 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 T5A BN1 N . 0.000 T5A BC6 C . 0.000 T5A BC2 C . 0.000 T5A BO2 O . 0.000 T5A BN3 N . 0.000 T5A BC4 C . 0.000 T5A BO4 O . 0.000 T5A BC5 C . 0.000 T5A BC7 C . 0.000 T5A BC5* C . 0.000 T5A BC4* C . 0.000 T5A BO4* O . 0.000 T5A BC1* C . 0.000 T5A BC2* C . 0.000 T5A BC3* C . 0.000 T5A BO3* O . 0.000 T5A PA P . 0.000 T5A O1A O . 0.000 T5A O2A O . 0.000 T5A BO5* O . 0.000 T5A O3A O . 0.000 T5A PB P . 0.000 T5A O1B O . 0.000 T5A O2B O . 0.000 T5A O3B O . 0.000 T5A PC P . 0.000 T5A O1C O . 0.000 T5A O2C O . 0.000 T5A O3C O . 0.000 T5A PD P . 0.000 T5A O1D O . 0.000 T5A O2D O . 0.000 T5A O3D O . 0.000 T5A PE P . 0.000 T5A O1E O . 0.000 T5A O2E O . 0.000 T5A AO5* O . 0.000 T5A AC5* C . 0.000 T5A AC4* C . 0.000 T5A AO4* O . 0.000 T5A AC1* C . 0.000 T5A AC2* C . 0.000 T5A AO2* O . 0.000 T5A AC3* C . 0.000 T5A AO3* O . 0.000 T5A AN9 N . 0.000 T5A AC4 C . 0.000 T5A AN3 N . 0.000 T5A AC2 C . 0.000 T5A AN1 N . 0.000 T5A AC6 C . 0.000 T5A AN6 N . 0.000 T5A AC5 C . 0.000 T5A AN7 N . 0.000 T5A AC8 C . 0.000 T5A HB6 H . 0.000 T5A HN3 H . 0.000 T5A HB71 H . 0.000 T5A HB72 H . 0.000 T5A HB73 H . 0.000 T5A HB51 H . 0.000 T5A HB52 H . 0.000 T5A HB4 H . 0.000 T5A HB1 H . 0.000 T5A HB21 H . 0.000 T5A HB22 H . 0.000 T5A HB3 H . 0.000 T5A HB*3 H . 0.000 T5A AHO1 H . 0.000 T5A BHO2 H . 0.000 T5A CHO2 H . 0.000 T5A DHO1 H . 0.000 T5A EHO1 H . 0.000 T5A HA51 H . 0.000 T5A HA52 H . 0.000 T5A HA4 H . 0.000 T5A HA1 H . 0.000 T5A HC2 H . 0.000 T5A HO2 H . 0.000 T5A HC3 H . 0.000 T5A HA3 H . 0.000 T5A HA2 H . 0.000 T5A HA61 H . 0.000 T5A HA62 H . 0.000 T5A HA8 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 T5A BN1 BC6 single T5A BN1 BC2 single T5A BN1 BC1* single T5A BC6 BC5 double T5A BC6 HB6 single T5A BC2 BO2 double T5A BC2 BN3 single T5A BN3 BC4 single T5A BN3 HN3 single T5A BC4 BO4 double T5A BC4 BC5 single T5A BC5 BC7 single T5A BC7 HB71 single T5A BC7 HB72 single T5A BC7 HB73 single T5A BC5* BC4* single T5A BC5* BO5* single T5A BC5* HB51 single T5A BC5* HB52 single T5A BC4* BO4* single T5A BC4* BC3* single T5A BC4* HB4 single T5A BO4* BC1* single T5A BC1* BC2* single T5A BC1* HB1 single T5A BC2* BC3* single T5A BC2* HB21 single T5A BC2* HB22 single T5A BC3* BO3* single T5A BC3* HB3 single T5A BO3* HB*3 single T5A PA O1A single T5A PA O2A double T5A PA BO5* single T5A PA O3A single T5A O1A AHO1 single T5A O3A PB single T5A PB O1B double T5A PB O2B single T5A PB O3B single T5A O2B BHO2 single T5A O3B PC single T5A PC O1C double T5A PC O2C single T5A PC O3C single T5A O2C CHO2 single T5A O3C PD single T5A PD O1D single T5A PD O2D double T5A PD O3D single T5A O1D DHO1 single T5A O3D PE single T5A PE O1E single T5A PE O2E double T5A PE AO5* single T5A O1E EHO1 single T5A AO5* AC5* single T5A AC5* AC4* single T5A AC5* HA51 single T5A AC5* HA52 single T5A AC4* AO4* single T5A AC4* AC3* single T5A AC4* HA4 single T5A AO4* AC1* single T5A AC1* AC2* single T5A AC1* AN9 single T5A AC1* HA1 single T5A AC2* AO2* single T5A AC2* AC3* single T5A AC2* HC2 single T5A AO2* HO2 single T5A AC3* AO3* single T5A AC3* HC3 single T5A AO3* HA3 single T5A AN9 AC4 single T5A AN9 AC8 single T5A AC4 AN3 single T5A AC4 AC5 double T5A AN3 AC2 double T5A AC2 AN1 single T5A AC2 HA2 single T5A AN1 AC6 double T5A AC6 AN6 single T5A AC6 AC5 single T5A AN6 HA61 single T5A AN6 HA62 single T5A AC5 AN7 single T5A AN7 AC8 double T5A AC8 HA8 single