# 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 FAG FAG '[1",2"-DIDEOXY[2-AMINO-5-([9-HYDROXY' non-polymer 74 47 M # data_comp_FAG # 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 FAG C3A C . 0.000 FAG C3 C . 0.000 FAG C2A C . 0.000 FAG C1 C . 0.000 FAG O1 O . 0.000 FAG P P . 0.000 FAG O1P O . 0.000 FAG O2P O . 0.000 FAG O5* O . 0.000 FAG C5* C . 0.000 FAG C4* C . 0.000 FAG O4* O . 0.000 FAG C1* C . 0.000 FAG N9 N . 0.000 FAG C4 C . 0.000 FAG N3 N . 0.000 FAG C2 C . 0.000 FAG N2 N . 0.000 FAG N1 N . 0.000 FAG C6 C . 0.000 FAG O6 O . 0.000 FAG C5 C . 0.000 FAG N7 N . 0.000 FAG C8 C . 0.000 FAG O8 O . 0.000 FAG C2* C . 0.000 FAG C3* C . 0.000 FAG O3* O . 0.000 FAG C8A C . 0.000 FAG C9 C . 0.000 FAG O9 O . 0.000 FAG C9A C . 0.000 FAG C9B C . 0.000 FAG O7 O . 0.000 FAG C6A C . 0.000 FAG O6A O . 0.000 FAG C5M C . 0.000 FAG C5B C . 0.000 FAG C4B C . 0.000 FAG O4 O . 0.000 FAG CM C . 0.000 FAG C4A C . 0.000 FAG AC10 C . 0.000 FAG O10 O . 0.000 FAG C11 C . 0.000 FAG O11 O . 0.000 FAG AC11 C . 0.000 FAG H1 H . 0.000 FAG H5B H . 0.000 FAG H31 H . 0.000 FAG H32 H . 0.000 FAG H2A1 H . 0.000 FAG H2A2 H . 0.000 FAG HOP2 H . 0.000 FAG H5*1 H . 0.000 FAG H5*2 H . 0.000 FAG H4* H . 0.000 FAG H1* H . 0.000 FAG HN9 H . 0.000 FAG HN21 H . 0.000 FAG HN22 H . 0.000 FAG H8 H . 0.000 FAG H2*1 H . 0.000 FAG H2*2 H . 0.000 FAG H3* H . 0.000 FAG HO3* H . 0.000 FAG H8A H . 0.000 FAG H9 H . 0.000 FAG HO9 H . 0.000 FAG H9A H . 0.000 FAG H6A H . 0.000 FAG HM1 H . 0.000 FAG HM2 H . 0.000 FAG HM3 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 FAG C3A C3 single FAG C3A C4A single FAG C3A AC11 double FAG C3 C2A single FAG C3 H31 single FAG C3 H32 single FAG C2A C1 single FAG C2A H2A1 single FAG C2A H2A2 single FAG C1 O1 double FAG C1 AC11 single FAG P O1P double FAG P O2P single FAG P O5* single FAG O2P HOP2 single FAG O5* C5* single FAG C5* C4* single FAG C5* H5*1 single FAG C5* H5*2 single FAG C4* O4* single FAG C4* C3* single FAG C4* H4* single FAG O4* C1* single FAG C1* N9 single FAG C1* C2* single FAG C1* H1* single FAG N9 C4 single FAG N9 HN9 single FAG C4 N3 single FAG C4 C5 double FAG N3 C2 double FAG C2 N2 single FAG C2 N1 single FAG N2 HN21 single FAG N2 HN22 single FAG N1 C6 single FAG N1 H1 single FAG C6 O6 double FAG C6 C5 single FAG C5 N7 single FAG N7 C8 single FAG N7 C8A single FAG C8 O8 double FAG C8 H8 single FAG C2* C3* single FAG C2* H2*1 single FAG C2* H2*2 single FAG C3* O3* single FAG C3* H3* single FAG O3* HO3* single FAG C8A C9 single FAG C8A O7 single FAG C8A H8A single FAG C9 O9 single FAG C9 C9A single FAG C9 H9 single FAG O9 HO9 single FAG C9A C9B single FAG C9A C6A single FAG C9A H9A single FAG C9B C5M double FAG C9B AC10 single FAG O7 C6A single FAG C6A O6A single FAG C6A H6A single FAG O6A C5M single FAG C5M C5B single FAG C5B C4B double FAG C5B H5B single FAG C4B O4 single FAG C4B C4A single FAG O4 CM single FAG CM HM1 single FAG CM HM2 single FAG CM HM3 single FAG C4A AC10 double FAG AC10 O10 single FAG O10 C11 single FAG C11 O11 double FAG C11 AC11 single