XmlmmCIF equivalent: chem_comp_bond
Data items in the CHEM_COMP_BOND category record details about
the bonds between atoms in a chemical component. Target values
may be specified as bond orders, as a distance between the two
atoms, or both.
XmlmmCIF equivalent: chem_comp_bond/value_dist
The value that should be taken as the target for the chemical
bond associated with the specified atoms, expressed as a
distance.
XmlmmCIF equivalent: chem_comp_bond/value_dist_esd
The estimated standard deviation of _chem_comp_bond.value_dist.
XmlmmCIF equivalent: chem_comp_bond/value_order
The value that should be taken as the target for the chemical
bond associated with the specified atoms, expressed as a bond
order.
XmlmmCIF equivalent: chem_comp_bond/comp_id
This data item is a pointer to _chem_comp.id in the CHEM_COMP
category.
XmlmmCIF equivalent: chem_comp_bond/atom_id_1
The id of the first of the two atoms that define the bond.
This data item is a pointer to _chem_comp_atom.atom_id in the
CHEM_COMP_ATOM category.
XmlmmCIF equivalent: chem_comp_bond/atom_id_2
The id of the second of the two atoms that define the bond.
This data item is a pointer to _chem_comp_atom.atom_id in the
CHEM_COMP_ATOM category.