global_
_lib_name         ?
_lib_version      ?
_lib_update       ?
# ------------------------------------------------
#
# ---   LIST OF MONOMERS ---
#
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
OZT      OZT '(4S,5R)-5-methyl-2-oxo-1,3-oxazolidi' non-polymer        16  10 .
# ------------------------------------------------------
# ------------------------------------------------------
#
# --- DESCRIPTION OF MONOMERS ---
#
data_comp_OZT
#
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
_chem_comp_atom.x
_chem_comp_atom.y
_chem_comp_atom.z
 OZT           OXT    O    OC       -0.500      0.000    0.000    0.000
 OZT           C      C    C         0.000     -1.134    0.528   -0.007
 OZT           O      O    OC       -0.500     -1.293    1.660   -0.516
 OZT           CA     C    CH1       0.000     -2.307   -0.199    0.597
 OZT           HA     H    H         0.000     -2.023   -0.666    1.551
 OZT           C2     C    CH1       0.000     -2.853   -1.256   -0.383
 OZT           H2     H    H         0.000     -2.269   -1.255   -1.314
 OZT           C7     C    CH3       0.000     -2.836   -2.643    0.260
 OZT           H37    H    H         0.000     -1.836   -2.929    0.461
 OZT           H27    H    H         0.000     -3.385   -2.620    1.166
 OZT           H17    H    H         0.000     -3.276   -3.345   -0.400
 OZT           N      N    NH1       0.000     -3.441    0.719    0.788
 OZT           HN     H    H         0.000     -3.438    1.541    1.376
 OZT           C5     C    C         0.000     -4.476    0.288    0.055
 OZT           O1     O    O2        0.000     -4.221   -0.826   -0.639
 OZT           O6     O    O         0.000     -5.549    0.859    0.022
loop_
_chem_comp_tree.comp_id
_chem_comp_tree.atom_id
_chem_comp_tree.atom_back
_chem_comp_tree.atom_forward
_chem_comp_tree.connect_type
 OZT      OXT    n/a    C      START
 OZT      C      OXT    CA     .
 OZT      O      C      .      .
 OZT      CA     C      N      .
 OZT      HA     CA     .      .
 OZT      C2     CA     C7     .
 OZT      H2     C2     .      .
 OZT      C7     C2     H17    .
 OZT      H37    C7     .      .
 OZT      H27    C7     .      .
 OZT      H17    C7     .      .
 OZT      N      CA     C5     .
 OZT      HN     N      .      .
 OZT      C5     N      O6     .
 OZT      O1     C5     .      .
 OZT      O6     C5     .      END
 OZT      O1     C2     .    ADD
loop_
_chem_comp_bond.comp_id
_chem_comp_bond.atom_id_1
_chem_comp_bond.atom_id_2
_chem_comp_bond.type
_chem_comp_bond.value_dist
_chem_comp_bond.value_dist_esd
 OZT      O1     C2        single      1.426    0.020
 OZT      O1     C5        single      1.454    0.020
 OZT      C2     CA        single      1.524    0.020
 OZT      C7     C2        single      1.524    0.020
 OZT      H2     C2        single      1.099    0.020
 OZT      N      CA        single      1.450    0.020
 OZT      CA     C         single      1.500    0.020
 OZT      HA     CA        single      1.099    0.020
 OZT      C5     N         single      1.330    0.020
 OZT      HN     N         single      1.010    0.020
 OZT      O6     C5        double      1.220    0.020
 OZT      H17    C7        single      1.059    0.020
 OZT      H27    C7        single      1.059    0.020
 OZT      H37    C7        single      1.059    0.020
 OZT      O      C         deloc       1.250    0.020
 OZT      C      OXT       deloc       1.250    0.020
loop_
_chem_comp_angle.comp_id
_chem_comp_angle.atom_id_1
_chem_comp_angle.atom_id_2
_chem_comp_angle.atom_id_3
_chem_comp_angle.value_angle
_chem_comp_angle.value_angle_esd
 OZT      OXT    C      O       123.000    3.000
 OZT      OXT    C      CA      118.500    3.000
 OZT      O      C      CA      118.500    3.000
 OZT      C      CA     HA      108.810    3.000
 OZT      C      CA     C2      109.470    3.000
 OZT      C      CA     N       111.600    3.000
 OZT      HA     CA     C2      108.340    3.000
 OZT      HA     CA     N       108.550    3.000
 OZT      C2     CA     N       110.000    3.000
 OZT      CA     C2     H2      108.340    3.000
 OZT      CA     C2     C7      111.000    3.000
 OZT      CA     C2     O1      109.470    3.000
 OZT      H2     C2     C7      108.340    3.000
 OZT      H2     C2     O1      109.470    3.000
 OZT      C7     C2     O1      109.470    3.000
 OZT      C2     C7     H37     109.470    3.000
 OZT      C2     C7     H27     109.470    3.000
 OZT      C2     C7     H17     109.470    3.000
 OZT      H37    C7     H27     109.470    3.000
 OZT      H37    C7     H17     109.470    3.000
 OZT      H27    C7     H17     109.470    3.000
 OZT      CA     N      HN      118.500    3.000
 OZT      CA     N      C5      121.500    3.000
 OZT      HN     N      C5      120.000    3.000
 OZT      N      C5     O1      118.000    3.000
 OZT      N      C5     O6      123.000    3.000
 OZT      O1     C5     O6      119.000    3.000
 OZT      C5     O1     C2      111.800    3.000
loop_
_chem_comp_tor.comp_id
_chem_comp_tor.id
_chem_comp_tor.atom_id_1
_chem_comp_tor.atom_id_2
_chem_comp_tor.atom_id_3
_chem_comp_tor.atom_id_4
_chem_comp_tor.value_angle
_chem_comp_tor.value_angle_esd
_chem_comp_tor.period
 OZT      var_1    OXT    C      CA     N        165.669   20.000   3
 OZT      var_2    C      CA     C2     C7       120.000   20.000   3
 OZT      var_3    CA     C2     C7     H17      176.062   20.000   3
 OZT      var_4    C      CA     N      C5       120.000   20.000   3
 OZT      CONST_1  CA     N      C5     O6       180.000    0.000   0
 OZT      var_5    N      C5     O1     C2         0.000   20.000   1
 OZT      var_6    C5     O1     C2     CA         0.000   20.000   1
loop_
_chem_comp_chir.comp_id
_chem_comp_chir.id
_chem_comp_chir.atom_id_centre
_chem_comp_chir.atom_id_1
_chem_comp_chir.atom_id_2
_chem_comp_chir.atom_id_3
_chem_comp_chir.volume_sign
 OZT      chir_01  C2     O1     CA     C7        negativ
 OZT      chir_02  CA     C2     N      C         positiv
loop_
_chem_comp_plane_atom.comp_id
_chem_comp_plane_atom.plane_id
_chem_comp_plane_atom.atom_id
_chem_comp_plane_atom.dist_esd
 OZT      plan-1    N         0.020
 OZT      plan-1    CA        0.020
 OZT      plan-1    C5        0.020
 OZT      plan-1    HN        0.020
 OZT      plan-2    C5        0.020
 OZT      plan-2    O1        0.020
 OZT      plan-2    N         0.020
 OZT      plan-2    O6        0.020
 OZT      plan-2    HN        0.020
 OZT      plan-3    C         0.020
 OZT      plan-3    CA        0.020
 OZT      plan-3    O         0.020
 OZT      plan-3    OXT       0.020
# ------------------------------------------------------
