<?xml version="1.0" encoding="UTF-8"?>
<emd xmlns:xsi="http://www.w3.org/2001/XMLSchema-instance" xsi:noNamespaceSchemaLocation="https://ftp.ebi.ac.uk/pub/databases/em_ebi/emdb_related/emdb-schemas/emdb_schemas/v3/v3_0_9_3/emdb.xsd" version="3.0.9.3" emdb_id="EMD-10848">
    <admin>
        <current_status>
            <date>2024-10-23</date>
            <code>REL</code>
            <processing_site>PDBe</processing_site>
        </current_status>
        <sites>
            <deposition>PDBe</deposition>
            <last_processing>PDBe</last_processing>
        </sites>
        <key_dates>
            <deposition>2020-04-10</deposition>
            <header_release>2020-09-09</header_release>
            <map_release>2020-09-09</map_release>
            <update>2024-10-23</update>
        </key_dates>
        <grant_support>
            <grant_reference>
                <funding_body>Swedish Research Council</funding_body>
                <code>2014-4116</code>
                <country>Sweden</country>
            </grant_reference>
            <grant_reference>
                <funding_body>Swedish Research Council</funding_body>
                <code>2018-03694</code>
                <country>Sweden</country>
            </grant_reference>
            <grant_reference>
                <funding_body>Knut and Alice Wallenberg Foundation</funding_body>
                <code>2017.0091</code>
                <country>Sweden</country>
            </grant_reference>
            <grant_reference>
                <funding_body>Knut and Alice Wallenberg Foundation</funding_body>
                <code>2013.0006</code>
                <country>Sweden</country>
            </grant_reference>
        </grant_support>
        <title>Cytochrome c oxidase from Saccharomyces cerevisiae</title>
        <authors_list>
            <author>Berndtsson J</author>
            <author>Rathore S</author>
            <author>Ott M</author>
        </authors_list>
        <keywords>CIV, CytcO, ELECTRON TRANSPORT</keywords>
    </admin>
    <crossreferences>
        <citation_list>
            <primary_citation>
                <journal_citation published="true">
                    <author ORCID="0000-0001-6627-8134" order="1">Berndtsson J</author>
                    <author ORCID="0000-0001-6571-2162" order="2">Aufschnaiter A</author>
                    <author order="3">Rathore S</author>
                    <author order="4">Marin-Buera L</author>
                    <author order="5">Dawitz H</author>
                    <author order="6">Diessl J</author>
                    <author ORCID="0000-0002-1241-162X" order="7">Kohler V</author>
                    <author ORCID="0000-0001-9018-3231" order="8">Barrientos A</author>
                    <author ORCID="0000-0002-2786-8542" order="9">Buttner S</author>
                    <author ORCID="0000-0003-0509-3835" order="10">Fontanesi F</author>
                    <author ORCID="0000-0001-6367-3091" order="11">Ott M</author>
                    <title>Respiratory supercomplexes enhance electron transport by decreasing cytochrome c diffusion distance.</title>
                    <journal_abbreviation>Embo Rep.</journal_abbreviation>
                    <country>UK</country>
                    <volume>21</volume>
                    <first_page>e51015</first_page>
                    <last_page>e51015</last_page>
                    <year>2020</year>
                    <external_references type="PUBMED">33016568</external_references>
                    <external_references type="DOI">doi:10.15252/embr.202051015</external_references>
                    <external_references type="ISSN">1469-3178</external_references>
                </journal_citation>
            </primary_citation>
        </citation_list>
        <pdb_list>
            <pdb_reference>
                <pdb_id>6ymy</pdb_id>
                <relationship>
                    <in_frame>FULLOVERLAP</in_frame>
                </relationship>
            </pdb_reference>
        </pdb_list>
    </crossreferences>
    <sample>
        <name>Cytochrome c oxidase</name>
        <supramolecule_list>
            <complex_supramolecule supramolecule_id="1">
                <name>Cytochrome c oxidase</name>
                <parent>0</parent>
                <macromolecule_list>
                    <macromolecule>
                        <macromolecule_id>1</macromolecule_id>
                    </macromolecule>
                    <macromolecule>
                        <macromolecule_id>2</macromolecule_id>
                    </macromolecule>
                    <macromolecule>
                        <macromolecule_id>3</macromolecule_id>
                    </macromolecule>
                    <macromolecule>
                        <macromolecule_id>4</macromolecule_id>
                    </macromolecule>
                    <macromolecule>
                        <macromolecule_id>5</macromolecule_id>
                    </macromolecule>
                    <macromolecule>
                        <macromolecule_id>6</macromolecule_id>
                    </macromolecule>
                    <macromolecule>
                        <macromolecule_id>7</macromolecule_id>
                    </macromolecule>
                    <macromolecule>
                        <macromolecule_id>8</macromolecule_id>
                    </macromolecule>
                    <macromolecule>
                        <macromolecule_id>9</macromolecule_id>
                    </macromolecule>
                    <macromolecule>
                        <macromolecule_id>10</macromolecule_id>
                    </macromolecule>
                    <macromolecule>
                        <macromolecule_id>11</macromolecule_id>
                    </macromolecule>
                    <macromolecule>
                        <macromolecule_id>12</macromolecule_id>
                    </macromolecule>
                </macromolecule_list>
                <natural_source database="NCBI">
                    <organism ncbi="559292">Saccharomyces cerevisiae (strain ATCC 204508 / S288c)</organism>
                    <strain>W303-1b</strain>
                    <organelle>Mitochondria</organelle>
                </natural_source>
            </complex_supramolecule>
        </supramolecule_list>
        <macromolecule_list>
            <protein_or_peptide macromolecule_id="1">
                <name>Cytochrome c oxidase subunit 1</name>
                <natural_source database="NCBI">
                    <organism ncbi="559292">Saccharomyces cerevisiae (strain ATCC 204508 / S288c)</organism>
                </natural_source>
                <molecular_weight>
                    <theoretical units="MDa">0.058316938</theoretical>
                </molecular_weight>
                <number_of_copies>1</number_of_copies>
                <enantiomer>LEVO</enantiomer>
                <sequence>
                    <string>WLYSTNAKDIAVLYFMLAIFSGMAGTAMSLIIRLELAAPGSQYLHGNSQLFNVLVVGHAVLMIFFLVMPALIGGFGNYLL
PLMIGATDTAFPRINNIAFWVLPMGLVCLVTSTLVESGAGTGWTVYPPLSSIQAHSGPSVDLAIFALHLTSISSLLGAIN
FIVTTLNMRTNGMTMHKLPLFVWSIFITAFLLLLSLPVLSAGITMLLLDRNFNTSFFEVSGGGDPILYEHLFWFFGHPEV
YILIIPGFGIISHVVSTYSKKPVFGEISMVYAMASIGLLGFLVWSHHMYIVGLDADTRAYFTSATMIIAIPTGIKIFSWL
ATIHGGSIRLATPMLYAIAFLFLFTMGGLTGVALANASLDVAFHDTYYVVGHFHYVLSMGAIFSLFAGYYYWSPQILGLN
YNEKLAQIQFWLIFIGANVIFFPMHFLGINGMPRRIPDYPDAFAGWNYVASIGSFIATLSLFLFIYILYDQLVNGLNNKV
NNKSVIYNKAPDFVESNTIFNLNTVKSSSIEFLLTSPPAVHSFNTPAVQS</string>
                    <external_references type="UNIPROTKB">P00401</external_references>
                </sequence>
                <ec_number>1.9.3.1</ec_number>
            </protein_or_peptide>
            <protein_or_peptide macromolecule_id="2">
                <name>Cytochrome c oxidase subunit 2</name>
                <natural_source database="NCBI">
                    <organism ncbi="559292">Saccharomyces cerevisiae (strain ATCC 204508 / S288c)</organism>
                </natural_source>
                <molecular_weight>
                    <theoretical units="MDa">0.026779815999999998</theoretical>
                </molecular_weight>
                <number_of_copies>1</number_of_copies>
                <enantiomer>LEVO</enantiomer>
                <sequence>
                    <string>DVPTPYACYFQDSATPNQEGILELHDNIMFYLLVILGLVSWMLYTIVMTYSKNPIAYKYIKHGQTIEVIWTIFPAVILLI
IAFPSFILLYLCDEVISPAMTIKAIGYQWYWKYEYSDFINDSGETVEFESYVIPDELLEEGQLRLLDTDTSMVVPVDTHI
RFVVTAADVIHDFAIPSLGIKVDATPGRLNQVSALIQREGVFYGACSELCGTGHANMPIKIEAVSLPKFLEWLNEQ</string>
                    <external_references type="UNIPROTKB">P00410</external_references>
                </sequence>
                <ec_number>1.9.3.1</ec_number>
            </protein_or_peptide>
            <protein_or_peptide macromolecule_id="3">
                <name>Cytochrome c oxidase subunit 3</name>
                <natural_source database="NCBI">
                    <organism ncbi="559292">Saccharomyces cerevisiae (strain ATCC 204508 / S288c)</organism>
                </natural_source>
                <molecular_weight>
                    <theoretical units="MDa">0.030252390999999997</theoretical>
                </molecular_weight>
                <number_of_copies>1</number_of_copies>
                <enantiomer>LEVO</enantiomer>
                <sequence>
                    <string>THLERSRHQQHPFHMVMPSPWPIVVSFALLSLALSTALTMHGYIGNMNMVYLALFVLLTSSILWFRDIVAEATYLGDHTM
AVRKGINLGFLMFVLSEVLIFAGLFWAYFHSAMSPDVTLGACWPPVGIEAVQPTELPLLNTIILLSSGATVTYSHHALIA
GNRNKALSGLLITFWLIVIFVTCQYIEYTNAAFTISDGVYGSVFYAGTGLHFLHMVMLAAMLGVNYWRMRNYHLTAGHHV
GYETTIIYTHVLDVIWLFLYVVFYWWGV</string>
                    <external_references type="UNIPROTKB">P00420</external_references>
                </sequence>
                <ec_number>1.9.3.1</ec_number>
            </protein_or_peptide>
            <protein_or_peptide macromolecule_id="4">
                <name>Cytochrome c oxidase subunit 4, mitochondrial</name>
                <natural_source database="NCBI">
                    <organism ncbi="559292">Saccharomyces cerevisiae (strain ATCC 204508 / S288c)</organism>
                </natural_source>
                <molecular_weight>
                    <theoretical units="MDa">0.012694381999999999</theoretical>
                </molecular_weight>
                <number_of_copies>1</number_of_copies>
                <enantiomer>LEVO</enantiomer>
                <sequence>
                    <string>VVKTAQNLAEVNGPETLIGPGAKEGTVPTDLDQETGLARLELLGKLEGIDVFDTKPLDSSRKGTMKDPIIIESYDDYRYV
GCTGSPAGSHTIMWLKPTVNEVARCWECGSVYKLNPV</string>
                    <external_references type="UNIPROTKB">P04037</external_references>
                </sequence>
            </protein_or_peptide>
            <protein_or_peptide macromolecule_id="5">
                <name>Cytochrome c oxidase subunit 5A, mitochondrial</name>
                <natural_source database="NCBI">
                    <organism ncbi="559292">Saccharomyces cerevisiae (strain ATCC 204508 / S288c)</organism>
                </natural_source>
                <molecular_weight>
                    <theoretical units="MDa">0.014324147</theoretical>
                </molecular_weight>
                <number_of_copies>1</number_of_copies>
                <enantiomer>LEVO</enantiomer>
                <sequence>
                    <string>ALSNAAVMDLQSRWENMPSTEQQDIVSKLSERQKLPWAQLTEPEKQAVWYISYGEWGPRRPVLNKGDSSFIAKGVAAGLL
FSVGLFAVVRMAGGQDAKTMNKEWQLKSDEYLKSKNANPWGGYSQVQS</string>
                    <external_references type="UNIPROTKB">P00424</external_references>
                </sequence>
            </protein_or_peptide>
            <protein_or_peptide macromolecule_id="6">
                <name>Cytochrome c oxidase subunit 6, mitochondrial</name>
                <natural_source database="NCBI">
                    <organism ncbi="559292">Saccharomyces cerevisiae (strain ATCC 204508 / S288c)</organism>
                </natural_source>
                <molecular_weight>
                    <theoretical units="MDa">0.011725173</theoretical>
                </molecular_weight>
                <number_of_copies>1</number_of_copies>
                <enantiomer>LEVO</enantiomer>
                <sequence>
                    <string>ETFEEFTARYEKEFDEAYDLFEVQRVLNNCFSYDLVPAPAVIEKALRAARRVNDLPTAIRVFEALKYKVENEDQYKAYLD
ELKDVRQELGVPLKEELFP</string>
                    <external_references type="UNIPROTKB">P00427</external_references>
                </sequence>
            </protein_or_peptide>
            <protein_or_peptide macromolecule_id="7">
                <name>Cytochrome c oxidase subunit 7, mitochondrial</name>
                <natural_source database="NCBI">
                    <organism ncbi="559292">Saccharomyces cerevisiae (strain ATCC 204508 / S288c)</organism>
                </natural_source>
                <molecular_weight>
                    <theoretical units="MDa">0.006410639</theoretical>
                </molecular_weight>
                <number_of_copies>1</number_of_copies>
                <enantiomer>LEVO</enantiomer>
                <sequence>
                    <string>NKVIQLQKIFQSSTKPLWWRHPRSALYLYPFYAIFAVAVVTPLLYIPNAIRGIKA</string>
                    <external_references type="UNIPROTKB">P10174</external_references>
                </sequence>
            </protein_or_peptide>
            <protein_or_peptide macromolecule_id="8">
                <name>Cytochrome c oxidase subunit 8, mitochondrial</name>
                <natural_source database="NCBI">
                    <organism ncbi="559292">Saccharomyces cerevisiae (strain ATCC 204508 / S288c)</organism>
                </natural_source>
                <molecular_weight>
                    <theoretical units="MDa">0.005737734999999999</theoretical>
                </molecular_weight>
                <number_of_copies>1</number_of_copies>
                <enantiomer>LEVO</enantiomer>
                <sequence>
                    <string>VHFKDGVYENIPFKVKGRKTPYALSHFGFFAIGFAVPFVACYVQLKKSGAF</string>
                    <external_references type="UNIPROTKB">P04039</external_references>
                </sequence>
            </protein_or_peptide>
            <protein_or_peptide macromolecule_id="9">
                <name>Cytochrome c oxidase subunit 9, mitochondrial</name>
                <natural_source database="NCBI">
                    <organism ncbi="559292">Saccharomyces cerevisiae (strain ATCC 204508 / S288c)</organism>
                </natural_source>
                <molecular_weight>
                    <theoretical units="MDa">0.006056131</theoretical>
                </molecular_weight>
                <number_of_copies>1</number_of_copies>
                <enantiomer>LEVO</enantiomer>
                <sequence>
                    <string>TIAPITGTIKRRVIMDIVLGFSLGGVMASYWWWGFHMDKINKREKFYAELAE</string>
                    <external_references type="UNIPROTKB">P07255</external_references>
                </sequence>
            </protein_or_peptide>
            <protein_or_peptide macromolecule_id="10">
                <name>Cytochrome c oxidase subunit 12, mitochondrial</name>
                <natural_source database="NCBI">
                    <organism ncbi="559292">Saccharomyces cerevisiae (strain ATCC 204508 / S288c)</organism>
                </natural_source>
                <molecular_weight>
                    <theoretical units="MDa">0.009225290999999998</theoretical>
                </molecular_weight>
                <number_of_copies>1</number_of_copies>
                <enantiomer>LEVO</enantiomer>
                <sequence>
                    <string>NSPLHTVGFDARFPQQNQTKHCWQSYVDYHKCVNMKGEDFAPCKVFWKTYNALCPLDWIEKWDDQREKGIFAGDINSD</string>
                    <external_references type="UNIPROTKB">Q01519</external_references>
                </sequence>
            </protein_or_peptide>
            <protein_or_peptide macromolecule_id="11">
                <name>Cytochrome c oxidase subunit 13, mitochondrial</name>
                <natural_source database="NCBI">
                    <organism ncbi="559292">Saccharomyces cerevisiae (strain ATCC 204508 / S288c)</organism>
                </natural_source>
                <molecular_weight>
                    <theoretical units="MDa">0.013306061</theoretical>
                </molecular_weight>
                <number_of_copies>1</number_of_copies>
                <enantiomer>LEVO</enantiomer>
                <sequence>
                    <string>NALKPAFGPPDKVAAQKFKESLMATEKHAKDTSNMWVKISVWVALPAIALTAVNTYFVEKEHAEHREHLKHVPDSEWPRD
YEFMNIRSKPFFWGDGDKTLFWNPVVNRHIEHDD</string>
                    <external_references type="UNIPROTKB">P32799</external_references>
                </sequence>
            </protein_or_peptide>
            <protein_or_peptide macromolecule_id="12">
                <name>Cytochrome c oxidase subunit 26, mitochondrial</name>
                <natural_source database="NCBI">
                    <organism ncbi="559292">Saccharomyces cerevisiae (strain ATCC 204508 / S288c)</organism>
                </natural_source>
                <molecular_weight>
                    <theoretical units="MDa">0.004347023</theoretical>
                </molecular_weight>
                <number_of_copies>1</number_of_copies>
                <enantiomer>LEVO</enantiomer>
                <sequence>
                    <string>ESWVITEGRRLIPEIFQWSAVLSVCLGWPGAVYFFSKA</string>
                    <external_references type="UNIPROTKB">Q2V2P9</external_references>
                </sequence>
            </protein_or_peptide>
            <ligand macromolecule_id="13">
                <name>COPPER (II) ION</name>
                <molecular_weight>
                    <theoretical units="MDa">6.354599999999999e-05</theoretical>
                </molecular_weight>
                <number_of_copies>1</number_of_copies>
                <formula>CU</formula>
            </ligand>
            <ligand macromolecule_id="14">
                <name>HEME-A</name>
                <molecular_weight>
                    <theoretical units="MDa">0.000852837</theoretical>
                </molecular_weight>
                <number_of_copies>2</number_of_copies>
                <formula>HEA</formula>
            </ligand>
            <ligand macromolecule_id="15">
                <name>PHOSPHATIDYLETHANOLAMINE</name>
                <molecular_weight>
                    <theoretical units="MDa">0.0007340389999999999</theoretical>
                </molecular_weight>
                <number_of_copies>7</number_of_copies>
                <formula>PTY</formula>
            </ligand>
            <ligand macromolecule_id="16">
                <name>(2R,5S,11R,14R)-5,8,11-trihydroxy-2-(nonanoyloxy)-5,11-dioxido-16-oxo-14-[(propanoyloxy)methyl]-4,6,10,12,15-pentaoxa-5,11-diphosphanonadec-1-yl undecanoate</name>
                <molecular_weight>
                    <theoretical units="MDa">0.0008348619999999999</theoretical>
                </molecular_weight>
                <number_of_copies>1</number_of_copies>
                <formula>CN3</formula>
            </ligand>
            <ligand macromolecule_id="17">
                <name>DINUCLEAR COPPER ION</name>
                <molecular_weight>
                    <theoretical units="MDa">0.00012709199999999998</theoretical>
                </molecular_weight>
                <number_of_copies>1</number_of_copies>
                <formula>CUA</formula>
            </ligand>
            <ligand macromolecule_id="18">
                <name>1,2-DIACYL-SN-GLYCERO-3-PHOSHOCHOLINE</name>
                <molecular_weight>
                    <theoretical units="MDa">0.0007340389999999999</theoretical>
                </molecular_weight>
                <number_of_copies>3</number_of_copies>
                <formula>PCF</formula>
            </ligand>
            <ligand macromolecule_id="19">
                <name>ZINC ION</name>
                <molecular_weight>
                    <theoretical units="MDa">6.5409e-05</theoretical>
                </molecular_weight>
                <number_of_copies>1</number_of_copies>
                <formula>ZN</formula>
            </ligand>
        </macromolecule_list>
    </sample>
    <structure_determination_list>
        <structure_determination structure_determination_id="1">
            <method>singleParticle</method>
            <aggregation_state>particle</aggregation_state>
            <specimen_preparation_list>
                <single_particle_preparation preparation_id="1">
                    <buffer>
                        <ph>7.4</ph>
                        <component>
                            <concentration units="mM">10.0</concentration>
                            <formula>C4H11NO3</formula>
                            <name>Tris</name>
                        </component>
                        <component>
                            <concentration units="mM">150.0</concentration>
                            <formula>NaCl</formula>
                            <name>Sodium chloride</name>
                        </component>
                        <component>
                            <concentration units="%">0.1</concentration>
                            <formula>C56H92O29</formula>
                            <name>Digitonin</name>
                        </component>
                        <component>
                            <concentration units="mM">1.0</concentration>
                            <formula>C7H7FO2S</formula>
                            <name>phenylmethylsulfonyl fluoride</name>
                        </component>
                    </buffer>
                    <grid>
                        <model>Homemade</model>
                        <material>COPPER</material>
                        <mesh>400</mesh>
                        <support_film film_type_id="1">
                            <film_material>CARBON</film_material>
                            <film_topology>LACEY</film_topology>
                        </support_film>
                        <pretreatment>
                            <type>GLOW DISCHARGE</type>
                            <time units="s">40</time>
                            <atmosphere>AIR</atmosphere>
                        </pretreatment>
                    </grid>
                    <vitrification>
                        <cryogen_name>ETHANE</cryogen_name>
                        <chamber_humidity units="percentage">100</chamber_humidity>
                        <chamber_temperature units="K">277.15</chamber_temperature>
                        <instrument>FEI VITROBOT MARK IV</instrument>
                    </vitrification>
                </single_particle_preparation>
            </specimen_preparation_list>
            <microscopy_list>
                <single_particle_microscopy microscopy_id="1">
                    <microscope>FEI TITAN KRIOS</microscope>
                    <illumination_mode>FLOOD BEAM</illumination_mode>
                    <imaging_mode>BRIGHT FIELD</imaging_mode>
                    <electron_source>FIELD EMISSION GUN</electron_source>
                    <acceleration_voltage units="kV">300</acceleration_voltage>
                    <c2_aperture_diameter units="µm">70.0</c2_aperture_diameter>
                    <nominal_cs units="mm">2.7</nominal_cs>
                    <nominal_defocus_min units="µm">-0.0014</nominal_defocus_min>
                    <nominal_defocus_max units="µm">-0.003</nominal_defocus_max>
                    <nominal_magnification>130000.0</nominal_magnification>
                    <specimen_holder_model>FEI TITAN KRIOS AUTOGRID HOLDER</specimen_holder_model>
                    <alignment_procedure>
                        <coma_free/>
                    </alignment_procedure>
                    <specialist_optics>
                        <energy_filter>
                            <name>GIF Bioquantum</name>
                            <slit_width units="eV">20</slit_width>
                        </energy_filter>
                    </specialist_optics>
                    <image_recording_list>
                        <image_recording image_recording_id="1">
                            <film_or_detector_model>GATAN K2 SUMMIT (4k x 4k)</film_or_detector_model>
                            <detector_mode>COUNTING</detector_mode>
                            <digitization_details>
                                <dimensions>
                                    <width units="pixel">3838</width>
                                    <height units="pixel">3710</height>
                                </dimensions>
                            </digitization_details>
                            <number_real_images>8775</number_real_images>
                            <average_exposure_time units="s">9.0</average_exposure_time>
                            <average_electron_dose_per_image units="e/Å^2">40.0</average_electron_dose_per_image>
                        </image_recording>
                    </image_recording_list>
                </single_particle_microscopy>
            </microscopy_list>
            <singleparticle_processing image_processing_id="1">
                <image_recording_id>1</image_recording_id>
                <particle_selection>
                    <number_selected>647805</number_selected>
                </particle_selection>
                <startup_model type_of_model="OTHER">
                    <details>ab initio</details>
                </startup_model>
                <final_reconstruction>
                    <number_classes_used>1</number_classes_used>
                    <resolution units="Å" res_type="BY AUTHOR">3.41</resolution>
                    <resolution_method>FSC 0.143 CUT-OFF</resolution_method>
                    <software_list>
                        <software>
                            <name>cryoSPARC</name>
                            <version>2</version>
                        </software>
                    </software_list>
                    <number_images_used>201223</number_images_used>
                </final_reconstruction>
                <initial_angle_assignment>
                    <type>OTHER</type>
                    <software_list>
                        <software>
                            <name>cryoSPARC</name>
                            <version>2</version>
                        </software>
                    </software_list>
                    <details>SGD</details>
                </initial_angle_assignment>
                <final_angle_assignment>
                    <type>MAXIMUM LIKELIHOOD</type>
                    <software_list>
                        <software>
                            <name>cryoSPARC</name>
                            <version>2</version>
                        </software>
                    </software_list>
                </final_angle_assignment>
                <final_three_d_classification>
                    <software_list>
                        <software>
                            <name>cryoSPARC</name>
                            <version>2</version>
                        </software>
                    </software_list>
                </final_three_d_classification>
            </singleparticle_processing>
        </structure_determination>
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