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    <admin>
        <current_status>
            <date>2025-08-13</date>
            <code>REL</code>
            <processing_site>PDBe</processing_site>
        </current_status>
        <sites>
            <deposition>PDBe</deposition>
            <last_processing>PDBe</last_processing>
        </sites>
        <key_dates>
            <deposition>2024-10-28</deposition>
            <header_release>2025-08-13</header_release>
            <map_release>2025-08-13</map_release>
            <update>2025-08-13</update>
        </key_dates>
        <grant_support>
            <grant_reference>
                <funding_body>Biotechnology and Biological Sciences Research Council (BBSRC)</funding_body>
                <code>BB/X007251/1</code>
                <country>United Kingdom</country>
            </grant_reference>
        </grant_support>
        <title>KtrA.ADP with a 54ms plunge time on the chameleon.</title>
        <authors_list>
            <author ORCID="0009-0005-7628-7233">Hirst IJ</author>
            <author ORCID="0000-0001-6869-4414">Muench SP</author>
            <author ORCID="0000-0001-6259-1684">Darrow MC</author>
            <author ORCID="0000-0001-6168-0060">Scarff CA</author>
            <author ORCID="0000-0002-4254-8854">Thompson RF</author>
        </authors_list>
        <keywords>sample preparation, air-water interface, potassium transport, RCK C domain, TRANSPORT PROTEIN</keywords>
    </admin>
    <crossreferences>
        <citation_list>
            <primary_citation>
                <journal_citation published="true">
                    <author order="1">Hirst IJ</author>
                    <author order="2">Chiang WT</author>
                    <author order="3">Hu NJ</author>
                    <author order="4">Scarff CA</author>
                    <author order="5">Thompson RF</author>
                    <author order="6">Darrow MC</author>
                    <author order="7">Muench SP</author>
                    <title>Untangling the effects of flexibility and the AWI in cryoEM sample preparation: A case study using KtrA.</title>
                    <journal_abbreviation>J.Struct.Biol.</journal_abbreviation>
                    <country>US</country>
                    <volume>217</volume>
                    <first_page>108206</first_page>
                    <last_page>108206</last_page>
                    <year>2025</year>
                    <external_references type="PUBMED">40324569</external_references>
                    <external_references type="DOI">doi:10.1016/j.jsb.2025.108206</external_references>
                    <external_references type="ISSN">1095-8657</external_references>
                    <external_references type="CSD">0803</external_references>
                    <external_references type="ASTM">JSBIEM</external_references>
                </journal_citation>
            </primary_citation>
        </citation_list>
        <other_db_list>
            <db_reference>
                <db_name>EMDB</db_name>
                <accession_id>EMD-51920</accession_id>
                <content_type>associated EM volume</content_type>
            </db_reference>
        </other_db_list>
    </crossreferences>
    <sample>
        <name>KtrA, the regulatory subunit from the KtrAB potassium transporter</name>
        <supramolecule_list>
            <complex_supramolecule supramolecule_id="1">
                <name>KtrA, the regulatory subunit from the KtrAB potassium transporter</name>
                <parent>0</parent>
                <details>This is map is part of an investigation into the effects of sample preparation on map quality.</details>
                <natural_source database="NCBI">
                    <organism ncbi="1423">Bascillus subtilis</organism>
                </natural_source>
                <molecular_weight>
                    <theoretical units="MDa">0.198</theoretical>
                </molecular_weight>
            </complex_supramolecule>
        </supramolecule_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">
                    <concentration units="mg/mL">8</concentration>
                    <buffer>
                        <ph>8.0</ph>
                        <component>
                            <concentration units="mM">150.0</concentration>
                            <formula>KCl</formula>
                            <name>potassium chloride</name>
                        </component>
                        <component>
                            <concentration units="mM">50.0</concentration>
                            <formula>Tris</formula>
                            <name>tris</name>
                        </component>
                        <details>50 mM Tris-HCl, 150 mM KCl, 0.5 mM TCEP</details>
                    </buffer>
                    <vitrification>
                        <cryogen_name>ETHANE</cryogen_name>
                        <chamber_humidity units="percentage">100</chamber_humidity>
                        <chamber_temperature units="K">277</chamber_temperature>
                        <instrument>SPOTITON</instrument>
                        <details>The commercialised version of the spotiton, the chameleon was used with a plunge time of 54 ms.
In-house self wicking grids from SPT Labtech were used.. </details>
                    </vitrification>
                </single_particle_preparation>
            </specimen_preparation_list>
            <microscopy_list>
                <single_particle_microscopy microscopy_id="1">
                    <microscope>TFS 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>
                    <nominal_cs units="mm">2.7</nominal_cs>
                    <nominal_defocus_min units="µm">1.5</nominal_defocus_min>
                    <nominal_defocus_max units="µm">3.0</nominal_defocus_max>
                    <nominal_magnification>96000.0</nominal_magnification>
                    <specimen_holder_model>FEI TITAN KRIOS AUTOGRID HOLDER</specimen_holder_model>
                    <cooling_holder_cryogen>NITROGEN</cooling_holder_cryogen>
                    <alignment_procedure>
                        <coma_free/>
                    </alignment_procedure>
                    <image_recording_list>
                        <image_recording image_recording_id="1">
                            <film_or_detector_model>FEI FALCON IV (4k x 4k)</film_or_detector_model>
                            <number_grids_imaged>1</number_grids_imaged>
                            <number_real_images>11631</number_real_images>
                            <average_exposure_time units="s">7.17</average_exposure_time>
                            <average_electron_dose_per_image units="e/Å^2">49.8</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>383653</number_selected>
                </particle_selection>
                <ctf_correction>
                    <software_list>
                        <software>
                            <name>RELION</name>
                            <version>4.0</version>
                            <processing_details>CTFFIND4 was used in relion for CTF estimation</processing_details>
                        </software>
                    </software_list>
                    <type>PHASE FLIPPING AND AMPLITUDE CORRECTION</type>
                </ctf_correction>
                <startup_model type_of_model="INSILICO MODEL">
                    <insilico_model>5 ab initio models</insilico_model>
                    <details>ab initio job in cryoSPARC with 5 classes</details>
                </startup_model>
                <final_reconstruction>
                    <resolution units="Å" res_type="BY AUTHOR">8.0</resolution>
                    <resolution_method>FSC 0.143 CUT-OFF</resolution_method>
                    <software_list>
                        <software>
                            <name>cryoSPARC</name>
                        </software>
                    </software_list>
                    <number_images_used>35383</number_images_used>
                </final_reconstruction>
                <initial_angle_assignment>
                    <type>MAXIMUM LIKELIHOOD</type>
                    <software_list>
                        <software>
                            <name>cryoSPARC</name>
                        </software>
                    </software_list>
                    <details>Non-uniform refinement</details>
                </initial_angle_assignment>
                <final_angle_assignment>
                    <type>MAXIMUM LIKELIHOOD</type>
                    <software_list>
                        <software>
                            <name>cryoSPARC</name>
                        </software>
                    </software_list>
                    <details>Non-uniform refinement</details>
                </final_angle_assignment>
            </singleparticle_processing>
        </structure_determination>
    </structure_determination_list>
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