<xsd:complexType name="pdbx_nmr_representativeType">
<xsd:annotation>
<xsd:documentation xml:lang="en">An average structure is often calculated in addition to the ensemble, or one of the ensemble is selected as a representative structure. This section describes selection of the representative structure. This example is drawn from the MCP-1 structure. <PDBx:pdbx_nmr_representativeCategory> <PDBx:pdbx_nmr_representative entry_id="1ABC"> <PDBx:conformer_id>15</PDBx:conformer_id> <PDBx:selection_criteria>lowest energy</PDBx:selection_criteria> </PDBx:pdbx_nmr_representative> </PDBx:pdbx_nmr_representativeCategory></xsd:documentation>
</xsd:annotation>
<xsd:sequence>
<xsd:element name="pdbx_nmr_representative" minOccurs="0" maxOccurs="unbounded">
<xsd:complexType>
<xsd:all>
<xsd:element name="conformer_id" minOccurs="0" maxOccurs="1" nillable="true" type="xsd:string">
<xsd:annotation>
<xsd:documentation xml:lang="en">If a member of the ensemble has been selected as a representative structure, identify it by its model number. 15</xsd:documentation>
</xsd:annotation>
</xsd:element>
<xsd:element name="selection_criteria" minOccurs="0" maxOccurs="1" nillable="true" type="xsd:string">
<xsd:annotation>
<xsd:documentation xml:lang="en">By highlighting the appropriate choice(s), describe the criteria used to select this structure as a representative structure, or if an average structure has been calculated describe how this was done. The structure closest to the average. The structure with the lowest energy was selected. The structure with the fewest number of violations was selected. A minimized average structure was calculated.</xsd:documentation>
</xsd:annotation>
</xsd:element>
</xsd:all>
<xsd:attribute name="entry_id" use="required" type="xsd:string">
<xsd:annotation>
<xsd:documentation xml:lang="en">msd will assign the ID.</xsd:documentation>
</xsd:annotation>
</xsd:attribute>
</xsd:complexType>
</xsd:element>
</xsd:sequence>
</xsd:complexType> |