PDBx:pdbx_refine_aux_fileType

Auxilary parameter and topology files used in refinement.
<PDBx:pdbx_refine_aux_fileCategory>
   <PDBx:pdbx_refine_aux_file pdbx_refine_id="x-ray" serial_no="1">
      <PDBx:file_name>parm_hol.dat</PDBx:file_name>
      <PDBx:file_type>PARAMETER</PDBx:file_type>
   </PDBx:pdbx_refine_aux_file>
</PDBx:pdbx_refine_aux_fileCategory>

Complex Type Information

Model

Used By

Source

<xsd:complexType name="pdbx_refine_aux_fileType">
  <xsd:annotation>
    <xsd:documentation xml:lang="en">Auxilary parameter and topology files used in refinement. <PDBx:pdbx_refine_aux_fileCategory> <PDBx:pdbx_refine_aux_file pdbx_refine_id="x-ray" serial_no="1"> <PDBx:file_name>parm_hol.dat</PDBx:file_name> <PDBx:file_type>PARAMETER</PDBx:file_type> </PDBx:pdbx_refine_aux_file> </PDBx:pdbx_refine_aux_fileCategory></xsd:documentation>
  </xsd:annotation>
  <xsd:sequence>
    <xsd:element name="pdbx_refine_aux_file" minOccurs="0" maxOccurs="unbounded">
      <xsd:complexType>
        <xsd:all>
          <xsd:element name="file_name" minOccurs="0" maxOccurs="1" nillable="true" type="xsd:string">
            <xsd:annotation>
              <xsd:documentation xml:lang="en">Auxilary file name. PARAM_NDBX_HIGH.DNA</xsd:documentation>
            </xsd:annotation>
          </xsd:element>
          <xsd:element name="file_type" minOccurs="0" maxOccurs="1" nillable="true">
            <xsd:annotation>
              <xsd:documentation xml:lang="en">Auxilary file type. PARAMETER</xsd:documentation>
            </xsd:annotation>
            <xsd:simpleType>
              <xsd:restriction base="xsd:string">
                <xsd:enumeration value="PARAMETER"/>
                <xsd:enumeration value="TOPOLOGY"/>
              </xsd:restriction>
            </xsd:simpleType>
          </xsd:element>
        </xsd:all>
        <xsd:attribute name="pdbx_refine_id" use="required" type="xsd:string">
          <xsd:annotation>
            <xsd:documentation xml:lang="en">This data item uniquely identifies a refinement within an entry. attribute pdbx_refine_id in category pdbx_refine_aux_file can be used to distinguish the results of joint refinements.</xsd:documentation>
          </xsd:annotation>
        </xsd:attribute>
        <xsd:attribute name="serial_no" use="required" type="xsd:string">
          <xsd:annotation>
            <xsd:documentation xml:lang="en">Serial number.</xsd:documentation>
          </xsd:annotation>
        </xsd:attribute>
      </xsd:complexType>
    </xsd:element>
  </xsd:sequence>
</xsd:complexType>