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|
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
DM6 DM6 '4'-EPIDOXORUBICIN ' non-polymer 69 39 .
# ------------------------------------------------------
# ------------------------------------------------------
#
# --- DESCRIPTION OF MONOMERS ---
#
data_comp_DM6
#
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
DM6 O13 O O 0.000 0.000 0.000 0.000
DM6 C13 C C 0.000 -0.131 -0.494 1.095
DM6 C14 C CH2 0.000 0.648 0.048 2.264
DM6 H141 H H 0.000 1.279 -0.742 2.678
DM6 H142 H H 0.000 -0.045 0.397 3.033
DM6 O14 O OH1 0.000 1.467 1.136 1.828
DM6 HO14 H H 0.000 1.967 1.483 2.579
DM6 C9 C CT 0.000 -1.077 -1.652 1.290
DM6 C8 C CH2 0.000 -2.441 -1.133 1.757
DM6 H82 H H 0.000 -2.366 -0.752 2.777
DM6 H81 H H 0.000 -3.178 -1.939 1.724
DM6 O9 O OH1 0.000 -0.542 -2.549 2.265
DM6 HO9 H H 0.000 0.309 -2.888 1.958
DM6 C10 C CH2 0.000 -1.271 -2.387 -0.035
DM6 H101 H H 0.000 -1.823 -3.310 0.152
DM6 H102 H H 0.000 -0.291 -2.629 -0.451
DM6 C19 C CR6 0.000 -2.036 -1.530 -1.010
DM6 C11 C CR6 0.000 -1.973 -1.886 -2.365
DM6 O11 O OH1 0.000 -1.240 -2.961 -2.745
DM6 HO11 H H 0.000 -0.336 -2.680 -2.943
DM6 C18 C CR66 0.000 -2.659 -1.143 -3.322
DM6 C17 C CR66 0.000 -3.423 -0.028 -2.917
DM6 C5 C CR6 0.000 -4.154 0.763 -3.926
DM6 O5 O O 0.000 -5.005 1.561 -3.584
DM6 C12 C CR6 0.000 -2.599 -1.508 -4.750
DM6 O12 O O 0.000 -2.162 -2.589 -5.091
DM6 C15 C CR66 0.000 -3.076 -0.540 -5.761
DM6 C16 C CR66 0.000 -3.834 0.576 -5.354
DM6 C4 C CR6 0.000 -4.288 1.488 -6.310
DM6 O4 O O2 0.000 -5.023 2.564 -5.931
DM6 C21 C CH3 0.000 -5.325 3.296 -7.119
DM6 H213 H H 0.000 -4.424 3.602 -7.585
DM6 H212 H H 0.000 -5.874 2.681 -7.784
DM6 H211 H H 0.000 -5.900 4.150 -6.872
DM6 C3 C CR16 0.000 -3.978 1.290 -7.653
DM6 H3 H H 0.000 -4.325 1.998 -8.395
DM6 C2 C CR16 0.000 -3.232 0.198 -8.043
DM6 H2 H H 0.000 -2.998 0.055 -9.090
DM6 C1 C CR16 0.000 -2.778 -0.718 -7.107
DM6 H1 H H 0.000 -2.192 -1.572 -7.424
DM6 C20 C CR6 0.000 -2.775 -0.443 -0.618
DM6 C6 C CR6 0.000 -3.475 0.312 -1.569
DM6 O6 O OH1 0.000 -4.207 1.383 -1.172
DM6 HO6 H H 0.000 -3.635 2.159 -1.112
DM6 C7 C CH1 0.000 -2.874 -0.007 0.821
DM6 H7 H H 0.000 -2.225 0.865 0.980
DM6 O7 O O2 0.000 -4.225 0.354 1.111
DM6 "C1'" C CH1 0.000 -4.174 1.493 1.973
DM6 "H1'" H H 0.000 -3.441 2.213 1.583
DM6 "O5'" O O2 0.000 -3.783 1.081 3.281
DM6 "C5'" C CH1 0.000 -4.651 0.021 3.678
DM6 "H5'" H H 0.000 -4.658 -0.756 2.901
DM6 "C6'" C CH3 0.000 -4.150 -0.579 4.992
DM6 "H6'3" H H 0.000 -3.167 -0.953 4.859
DM6 "H6'2" H H 0.000 -4.144 0.168 5.743
DM6 "H6'1" H H 0.000 -4.790 -1.370 5.287
DM6 "C4'" C CH1 0.000 -6.070 0.561 3.873
DM6 "H4'" H H 0.000 -6.061 1.354 4.634
DM6 "O4'" O OH1 0.000 -6.931 -0.498 4.296
DM6 "HO'4" H H 0.000 -6.611 -0.858 5.135
DM6 "C3'" C CH1 0.000 -6.575 1.131 2.543
DM6 "H3'" H H 0.000 -6.685 0.318 1.811
DM6 "N3'" N NT3 1.000 -7.872 1.790 2.746
DM6 "HN'3" H H 0.000 -8.554 1.098 3.091
DM6 "HN'2" H H 0.000 -7.764 2.548 3.438
DM6 "HN'1" H H 0.000 -8.198 2.182 1.849
DM6 "C2'" C CH2 0.000 -5.554 2.152 2.028
DM6 "H2'2" H H 0.000 -5.522 3.011 2.702
DM6 "H2'1" H H 0.000 -5.840 2.486 1.028
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
DM6 O13 n/a C13 START
DM6 C13 O13 C9 .
DM6 C14 C13 O14 .
DM6 H141 C14 . .
DM6 H142 C14 . .
DM6 O14 C14 HO14 .
DM6 HO14 O14 . .
DM6 C9 C13 C10 .
DM6 C8 C9 H81 .
DM6 H82 C8 . .
DM6 H81 C8 . .
DM6 O9 C9 HO9 .
DM6 HO9 O9 . .
DM6 C10 C9 C19 .
DM6 H101 C10 . .
DM6 H102 C10 . .
DM6 C19 C10 C20 .
DM6 C11 C19 C18 .
DM6 O11 C11 HO11 .
DM6 HO11 O11 . .
DM6 C18 C11 C12 .
DM6 C17 C18 C5 .
DM6 C5 C17 O5 .
DM6 O5 C5 . .
DM6 C12 C18 C15 .
DM6 O12 C12 . .
DM6 C15 C12 C1 .
DM6 C16 C15 C4 .
DM6 C4 C16 C3 .
DM6 O4 C4 C21 .
DM6 C21 O4 H211 .
DM6 H213 C21 . .
DM6 H212 C21 . .
DM6 H211 C21 . .
DM6 C3 C4 C2 .
DM6 H3 C3 . .
DM6 C2 C3 H2 .
DM6 H2 C2 . .
DM6 C1 C15 H1 .
DM6 H1 C1 . .
DM6 C20 C19 C7 .
DM6 C6 C20 O6 .
DM6 O6 C6 HO6 .
DM6 HO6 O6 . .
DM6 C7 C20 O7 .
DM6 H7 C7 . .
DM6 O7 C7 "C1'" .
DM6 "C1'" O7 "O5'" .
DM6 "H1'" "C1'" . .
DM6 "O5'" "C1'" "C5'" .
DM6 "C5'" "O5'" "C4'" .
DM6 "H5'" "C5'" . .
DM6 "C6'" "C5'" "H6'1" .
DM6 "H6'3" "C6'" . .
DM6 "H6'2" "C6'" . .
DM6 "H6'1" "C6'" . .
DM6 "C4'" "C5'" "C3'" .
DM6 "H4'" "C4'" . .
DM6 "O4'" "C4'" "HO'4" .
DM6 "HO'4" "O4'" . .
DM6 "C3'" "C4'" "C2'" .
DM6 "H3'" "C3'" . .
DM6 "N3'" "C3'" "HN'1" .
DM6 "HN'3" "N3'" . .
DM6 "HN'2" "N3'" . .
DM6 "HN'1" "N3'" . .
DM6 "C2'" "C3'" "H2'1" .
DM6 "H2'2" "C2'" . .
DM6 "H2'1" "C2'" . END
DM6 C1 C2 . ADD
DM6 C5 C16 . ADD
DM6 C6 C17 . ADD
DM6 C7 C8 . ADD
DM6 "C1'" "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
DM6 C1 C2 double 1.390 0.020
DM6 C1 C15 single 1.390 0.020
DM6 H1 C1 single 1.083 0.020
DM6 C2 C3 single 1.390 0.020
DM6 H2 C2 single 1.083 0.020
DM6 C3 C4 double 1.390 0.020
DM6 H3 C3 single 1.083 0.020
DM6 C4 C16 single 1.490 0.020
DM6 O4 C4 single 1.370 0.020
DM6 C5 C16 single 1.490 0.020
DM6 C5 C17 single 1.490 0.020
DM6 O5 C5 double 1.250 0.020
DM6 C6 C17 double 1.490 0.020
DM6 C6 C20 single 1.487 0.020
DM6 O6 C6 single 1.362 0.020
DM6 C7 C8 single 1.524 0.020
DM6 C7 C20 single 1.480 0.020
DM6 O7 C7 single 1.426 0.020
DM6 H7 C7 single 1.099 0.020
DM6 C8 C9 single 1.524 0.020
DM6 H81 C8 single 1.092 0.020
DM6 H82 C8 single 1.092 0.020
DM6 C10 C9 single 1.524 0.020
DM6 C9 C13 single 1.507 0.020
DM6 O9 C9 single 1.432 0.020
DM6 C19 C10 single 1.511 0.020
DM6 H101 C10 single 1.092 0.020
DM6 H102 C10 single 1.092 0.020
DM6 C18 C11 double 1.490 0.020
DM6 C11 C19 single 1.487 0.020
DM6 O11 C11 single 1.362 0.020
DM6 C15 C12 single 1.490 0.020
DM6 C12 C18 single 1.490 0.020
DM6 O12 C12 double 1.250 0.020
DM6 C14 C13 single 1.510 0.020
DM6 C13 O13 double 1.220 0.020
DM6 O14 C14 single 1.432 0.020
DM6 H141 C14 single 1.092 0.020
DM6 H142 C14 single 1.092 0.020
DM6 C16 C15 double 1.490 0.020
DM6 C17 C18 single 1.490 0.020
DM6 C20 C19 double 1.487 0.020
DM6 C21 O4 single 1.426 0.020
DM6 H211 C21 single 1.059 0.020
DM6 H212 C21 single 1.059 0.020
DM6 H213 C21 single 1.059 0.020
DM6 HO6 O6 single 0.967 0.020
DM6 "C1'" O7 single 1.426 0.020
DM6 HO9 O9 single 0.967 0.020
DM6 HO11 O11 single 0.967 0.020
DM6 HO14 O14 single 0.967 0.020
DM6 "C1'" "C2'" single 1.524 0.020
DM6 "O5'" "C1'" single 1.426 0.020
DM6 "H1'" "C1'" single 1.099 0.020
DM6 "C2'" "C3'" single 1.524 0.020
DM6 "H2'1" "C2'" single 1.092 0.020
DM6 "H2'2" "C2'" single 1.092 0.020
DM6 "C3'" "C4'" single 1.524 0.020
DM6 "N3'" "C3'" single 1.488 0.020
DM6 "H3'" "C3'" single 1.099 0.020
DM6 "C4'" "C5'" single 1.524 0.020
DM6 "O4'" "C4'" single 1.432 0.020
DM6 "H4'" "C4'" single 1.099 0.020
DM6 "C6'" "C5'" single 1.524 0.020
DM6 "C5'" "O5'" single 1.426 0.020
DM6 "H5'" "C5'" single 1.099 0.020
DM6 "H6'1" "C6'" single 1.059 0.020
DM6 "H6'2" "C6'" single 1.059 0.020
DM6 "H6'3" "C6'" single 1.059 0.020
DM6 "HO'4" "O4'" single 0.967 0.020
DM6 "HN'1" "N3'" single 1.033 0.020
DM6 "HN'2" "N3'" single 1.033 0.020
DM6 "HN'3" "N3'" single 1.033 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
DM6 O13 C13 C14 120.500 3.000
DM6 O13 C13 C9 120.500 3.000
DM6 C14 C13 C9 120.000 3.000
DM6 C13 C14 H141 109.470 3.000
DM6 C13 C14 H142 109.470 3.000
DM6 C13 C14 O14 109.500 3.000
DM6 H141 C14 H142 107.900 3.000
DM6 H141 C14 O14 109.470 3.000
DM6 H142 C14 O14 109.470 3.000
DM6 C14 O14 HO14 109.470 3.000
DM6 C13 C9 C8 109.470 3.000
DM6 C13 C9 O9 109.470 3.000
DM6 C13 C9 C10 109.470 3.000
DM6 C8 C9 O9 109.470 3.000
DM6 C8 C9 C10 111.000 3.000
DM6 O9 C9 C10 109.470 3.000
DM6 C9 C8 H82 109.470 3.000
DM6 C9 C8 H81 109.470 3.000
DM6 C9 C8 C7 111.000 3.000
DM6 H82 C8 H81 107.900 3.000
DM6 H82 C8 C7 109.470 3.000
DM6 H81 C8 C7 109.470 3.000
DM6 C9 O9 HO9 109.470 3.000
DM6 C9 C10 H101 109.470 3.000
DM6 C9 C10 H102 109.470 3.000
DM6 C9 C10 C19 109.470 3.000
DM6 H101 C10 H102 107.900 3.000
DM6 H101 C10 C19 109.470 3.000
DM6 H102 C10 C19 109.470 3.000
DM6 C10 C19 C11 120.000 3.000
DM6 C10 C19 C20 120.000 3.000
DM6 C11 C19 C20 120.000 3.000
DM6 C19 C11 O11 120.000 3.000
DM6 C19 C11 C18 120.000 3.000
DM6 O11 C11 C18 120.000 3.000
DM6 C11 O11 HO11 109.470 3.000
DM6 C11 C18 C17 120.000 3.000
DM6 C11 C18 C12 120.000 3.000
DM6 C17 C18 C12 120.000 3.000
DM6 C18 C17 C5 120.000 3.000
DM6 C18 C17 C6 120.000 3.000
DM6 C5 C17 C6 120.000 3.000
DM6 C17 C5 O5 120.000 3.000
DM6 C17 C5 C16 120.000 3.000
DM6 O5 C5 C16 120.000 3.000
DM6 C18 C12 O12 120.000 3.000
DM6 C18 C12 C15 120.000 3.000
DM6 O12 C12 C15 120.000 3.000
DM6 C12 C15 C16 120.000 3.000
DM6 C12 C15 C1 120.000 3.000
DM6 C16 C15 C1 120.000 3.000
DM6 C15 C16 C4 120.000 3.000
DM6 C15 C16 C5 120.000 3.000
DM6 C4 C16 C5 120.000 3.000
DM6 C16 C4 O4 120.000 3.000
DM6 C16 C4 C3 120.000 3.000
DM6 O4 C4 C3 120.000 3.000
DM6 C4 O4 C21 120.000 3.000
DM6 O4 C21 H213 109.470 3.000
DM6 O4 C21 H212 109.470 3.000
DM6 O4 C21 H211 109.470 3.000
DM6 H213 C21 H212 109.470 3.000
DM6 H213 C21 H211 109.470 3.000
DM6 H212 C21 H211 109.470 3.000
DM6 C4 C3 H3 120.000 3.000
DM6 C4 C3 C2 120.000 3.000
DM6 H3 C3 C2 120.000 3.000
DM6 C3 C2 H2 120.000 3.000
DM6 C3 C2 C1 120.000 3.000
DM6 H2 C2 C1 120.000 3.000
DM6 C15 C1 H1 120.000 3.000
DM6 C15 C1 C2 120.000 3.000
DM6 H1 C1 C2 120.000 3.000
DM6 C19 C20 C6 120.000 3.000
DM6 C19 C20 C7 120.000 3.000
DM6 C6 C20 C7 120.000 3.000
DM6 C20 C6 O6 120.000 3.000
DM6 C20 C6 C17 120.000 3.000
DM6 O6 C6 C17 120.000 3.000
DM6 C6 O6 HO6 109.470 3.000
DM6 C20 C7 H7 109.470 3.000
DM6 C20 C7 O7 109.470 3.000
DM6 C20 C7 C8 109.470 3.000
DM6 H7 C7 O7 109.470 3.000
DM6 H7 C7 C8 108.340 3.000
DM6 O7 C7 C8 109.470 3.000
DM6 C7 O7 "C1'" 111.800 3.000
DM6 O7 "C1'" "H1'" 109.470 3.000
DM6 O7 "C1'" "O5'" 109.470 3.000
DM6 O7 "C1'" "C2'" 109.470 3.000
DM6 "H1'" "C1'" "O5'" 109.470 3.000
DM6 "H1'" "C1'" "C2'" 108.340 3.000
DM6 "O5'" "C1'" "C2'" 109.470 3.000
DM6 "C1'" "O5'" "C5'" 111.800 3.000
DM6 "O5'" "C5'" "H5'" 109.470 3.000
DM6 "O5'" "C5'" "C6'" 109.470 3.000
DM6 "O5'" "C5'" "C4'" 109.470 3.000
DM6 "H5'" "C5'" "C6'" 108.340 3.000
DM6 "H5'" "C5'" "C4'" 108.340 3.000
DM6 "C6'" "C5'" "C4'" 111.000 3.000
DM6 "C5'" "C6'" "H6'3" 109.470 3.000
DM6 "C5'" "C6'" "H6'2" 109.470 3.000
DM6 "C5'" "C6'" "H6'1" 109.470 3.000
DM6 "H6'3" "C6'" "H6'2" 109.470 3.000
DM6 "H6'3" "C6'" "H6'1" 109.470 3.000
DM6 "H6'2" "C6'" "H6'1" 109.470 3.000
DM6 "C5'" "C4'" "H4'" 108.340 3.000
DM6 "C5'" "C4'" "O4'" 109.470 3.000
DM6 "C5'" "C4'" "C3'" 111.000 3.000
DM6 "H4'" "C4'" "O4'" 109.470 3.000
DM6 "H4'" "C4'" "C3'" 108.340 3.000
DM6 "O4'" "C4'" "C3'" 109.470 3.000
DM6 "C4'" "O4'" "HO'4" 109.470 3.000
DM6 "C4'" "C3'" "H3'" 108.340 3.000
DM6 "C4'" "C3'" "N3'" 110.000 3.000
DM6 "C4'" "C3'" "C2'" 111.000 3.000
DM6 "H3'" "C3'" "N3'" 108.550 3.000
DM6 "H3'" "C3'" "C2'" 108.340 3.000
DM6 "N3'" "C3'" "C2'" 110.000 3.000
DM6 "C3'" "N3'" "HN'3" 109.470 3.000
DM6 "C3'" "N3'" "HN'2" 109.470 3.000
DM6 "C3'" "N3'" "HN'1" 109.470 3.000
DM6 "HN'3" "N3'" "HN'2" 109.470 3.000
DM6 "HN'3" "N3'" "HN'1" 109.470 3.000
DM6 "HN'2" "N3'" "HN'1" 109.470 3.000
DM6 "C3'" "C2'" "H2'2" 109.470 3.000
DM6 "C3'" "C2'" "H2'1" 109.470 3.000
DM6 "C3'" "C2'" "C1'" 111.000 3.000
DM6 "H2'2" "C2'" "H2'1" 107.900 3.000
DM6 "H2'2" "C2'" "C1'" 109.470 3.000
DM6 "H2'1" "C2'" "C1'" 109.470 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
DM6 var_1 O13 C13 C14 O14 0.003 20.000 3
DM6 var_2 C13 C14 O14 HO14 -179.962 20.000 1
DM6 var_3 O13 C13 C9 C10 24.246 20.000 1
DM6 var_4 C13 C9 C8 C7 60.000 20.000 1
DM6 var_5 C13 C9 O9 HO9 -60.562 20.000 1
DM6 var_6 C13 C9 C10 C19 -60.000 20.000 1
DM6 var_7 C9 C10 C19 C20 -30.000 20.000 2
DM6 CONST_1 C10 C19 C11 C18 180.000 0.000 0
DM6 var_8 C19 C11 O11 HO11 -90.026 20.000 1
DM6 CONST_2 C19 C11 C18 C12 180.000 0.000 0
DM6 CONST_3 C11 C18 C17 C5 180.000 0.000 0
DM6 CONST_4 C18 C17 C5 O5 180.000 0.000 0
DM6 CONST_5 C17 C5 C16 C15 0.000 0.000 0
DM6 CONST_6 C11 C18 C12 C15 180.000 0.000 0
DM6 CONST_7 C18 C12 C15 C1 180.000 0.000 0
DM6 CONST_8 C12 C15 C16 C4 180.000 0.000 0
DM6 CONST_9 C15 C16 C4 C3 0.000 0.000 0
DM6 var_9 C16 C4 O4 C21 179.723 20.000 1
DM6 var_10 C4 O4 C21 H211 179.989 20.000 1
DM6 CONST_10 C16 C4 C3 C2 0.000 0.000 0
DM6 CONST_11 C4 C3 C2 C1 0.000 0.000 0
DM6 CONST_12 C12 C15 C1 C2 180.000 0.000 0
DM6 CONST_13 C15 C1 C2 C3 0.000 0.000 0
DM6 CONST_14 C10 C19 C20 C7 0.000 0.000 0
DM6 CONST_15 C19 C20 C6 O6 180.000 0.000 0
DM6 CONST_16 C20 C6 C17 C18 0.000 0.000 0
DM6 var_11 C20 C6 O6 HO6 85.107 20.000 1
DM6 var_12 C19 C20 C7 O7 -150.000 20.000 1
DM6 var_13 C20 C7 C8 C9 60.000 20.000 3
DM6 var_14 C20 C7 O7 "C1'" -141.661 20.000 1
DM6 var_15 C7 O7 "C1'" "O5'" -74.421 20.000 1
DM6 var_16 O7 "C1'" "C2'" "C3'" 60.000 20.000 3
DM6 var_17 O7 "C1'" "O5'" "C5'" -60.000 20.000 1
DM6 var_18 "C1'" "O5'" "C5'" "C4'" -60.000 20.000 1
DM6 var_19 "O5'" "C5'" "C6'" "H6'1" -179.731 20.000 3
DM6 var_20 "O5'" "C5'" "C4'" "C3'" 60.000 20.000 3
DM6 var_21 "C5'" "C4'" "O4'" "HO'4" 60.395 20.000 1
DM6 var_22 "C5'" "C4'" "C3'" "C2'" -60.000 20.000 3
DM6 var_23 "C4'" "C3'" "N3'" "HN'1" 179.208 20.000 1
DM6 var_24 "C4'" "C3'" "C2'" "C1'" 60.000 20.000 3
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
DM6 chir_01 C7 C8 C20 O7 negativ
DM6 chir_02 C9 C8 C10 C13 negativ
DM6 chir_03 "C1'" O7 "C2'" "O5'" negativ
DM6 chir_04 "C3'" "C2'" "C4'" "N3'" negativ
DM6 chir_05 "C4'" "C3'" "C5'" "O4'" positiv
DM6 chir_06 "C5'" "C4'" "C6'" "O5'" 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
DM6 plan-1 C1 0.020
DM6 plan-1 C2 0.020
DM6 plan-1 C15 0.020
DM6 plan-1 H1 0.020
DM6 plan-1 C3 0.020
DM6 plan-1 C4 0.020
DM6 plan-1 H2 0.020
DM6 plan-1 H3 0.020
DM6 plan-1 C16 0.020
DM6 plan-1 O4 0.020
DM6 plan-1 C5 0.020
DM6 plan-1 C17 0.020
DM6 plan-1 O5 0.020
DM6 plan-1 C12 0.020
DM6 plan-1 C18 0.020
DM6 plan-1 O12 0.020
DM6 plan-1 C6 0.020
DM6 plan-1 C11 0.020
DM6 plan-1 C19 0.020
DM6 plan-1 C20 0.020
DM6 plan-1 O6 0.020
DM6 plan-1 O11 0.020
DM6 plan-1 C10 0.020
DM6 plan-1 C7 0.020
DM6 plan-2 C13 0.020
DM6 plan-2 C9 0.020
DM6 plan-2 C14 0.020
DM6 plan-2 O13 0.020
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