data_EMD-72036
# 
_entry.id   EMD-72036 
# 
_audit_conform.dict_name       mmcif_pdbx.dic 
_audit_conform.dict_version    5.409 
_audit_conform.dict_location   http://mmcif.pdb.org/dictionaries/ascii/mmcif_pdbx.dic 
# 
loop_
_database_2.database_id 
_database_2.database_code 
_database_2.pdbx_database_accession 
_database_2.pdbx_DOI 
PDB   9PYM         pdb_00009pym 10.2210/pdb9pym/pdb 
WWPDB D_1000298581 ?            ?                   
EMDB  EMD-72036    ?            ?                   
# 
loop_
_pdbx_audit_revision_history.ordinal 
_pdbx_audit_revision_history.data_content_type 
_pdbx_audit_revision_history.major_revision 
_pdbx_audit_revision_history.minor_revision 
_pdbx_audit_revision_history.revision_date 
_pdbx_audit_revision_history.part_number 
1  'Structure model' 1 0 2025-11-12 ? 
2  'EM metadata'     1 0 2025-11-12 ? 
3  'Half map'        1 0 2025-11-12 1 
4  'Half map'        1 0 2025-11-12 2 
5  Image             1 0 2025-11-12 ? 
6  'Primary map'     1 0 2025-11-12 ? 
7  'Structure model' 1 1 2025-11-19 ? 
8  'Half map'        1 0 2025-11-12 1 
9  'Half map'        1 0 2025-11-12 2 
10 Image             1 0 2025-11-12 ? 
11 'Primary map'     1 0 2025-11-12 ? 
12 'Structure model' 1 2 2026-01-21 ? 
13 'EM metadata'     1 1 2026-01-21 ? 
# 
loop_
_pdbx_audit_revision_details.ordinal 
_pdbx_audit_revision_details.revision_ordinal 
_pdbx_audit_revision_details.data_content_type 
_pdbx_audit_revision_details.provider 
_pdbx_audit_revision_details.type 
_pdbx_audit_revision_details.description 
_pdbx_audit_revision_details.details 
1  1  'Structure model' repository 'Initial release' ? ? 
2  2  'EM metadata'     repository 'Initial release' ? ? 
3  3  'Half map'        repository 'Initial release' ? ? 
4  4  'Half map'        repository 'Initial release' ? ? 
5  5  Image             repository 'Initial release' ? ? 
6  6  'Primary map'     repository 'Initial release' ? ? 
7  8  'Half map'        repository 'Initial release' ? ? 
8  9  'Half map'        repository 'Initial release' ? ? 
9  10 Image             repository 'Initial release' ? ? 
10 11 'Primary map'     repository 'Initial release' ? ? 
# 
loop_
_pdbx_audit_revision_group.ordinal 
_pdbx_audit_revision_group.revision_ordinal 
_pdbx_audit_revision_group.data_content_type 
_pdbx_audit_revision_group.group 
1 7  'Structure model' 'Data collection'      
2 7  'Structure model' 'Database references'  
3 12 'Structure model' 'Data collection'      
4 12 'Structure model' 'Database references'  
5 13 'EM metadata'     'Database references'  
6 13 'EM metadata'     'Experimental summary' 
# 
loop_
_pdbx_audit_revision_category.ordinal 
_pdbx_audit_revision_category.revision_ordinal 
_pdbx_audit_revision_category.data_content_type 
_pdbx_audit_revision_category.category 
1 7  'Structure model' citation        
2 7  'Structure model' citation_author 
3 7  'Structure model' em_admin        
4 12 'Structure model' citation        
5 12 'Structure model' em_admin        
6 13 'EM metadata'     citation        
7 13 'EM metadata'     em_admin        
# 
loop_
_pdbx_audit_revision_item.ordinal 
_pdbx_audit_revision_item.revision_ordinal 
_pdbx_audit_revision_item.data_content_type 
_pdbx_audit_revision_item.item 
1  7  'Structure model' '_citation.pdbx_database_id_PubMed' 
2  7  'Structure model' '_citation.title'                   
3  7  'Structure model' '_citation_author.name'             
4  7  'Structure model' '_em_admin.last_update'             
5  12 'Structure model' '_citation.journal_volume'          
6  12 'Structure model' '_citation.page_first'              
7  12 'Structure model' '_citation.year'                    
8  12 'Structure model' '_em_admin.last_update'             
9  13 'EM metadata'     '_citation.journal_volume'          
10 13 'EM metadata'     '_citation.page_first'              
11 13 'EM metadata'     '_citation.year'                    
12 13 'EM metadata'     '_em_admin.last_update'             
# 
_pdbx_database_related.db_name        EMDB 
_pdbx_database_related.details        
'Cryo-EM structure of the isethionate TRAP transporter IseQM from Oleidesulfovibrio alaskensis with bound isethionate' 
_pdbx_database_related.db_id          EMD-72036 
_pdbx_database_related.content_type   'associated EM volume' 
# 
_citation.abstract                  ? 
_citation.abstract_id_CAS           ? 
_citation.book_id_ISBN              ? 
_citation.book_publisher            ? 
_citation.book_publisher_city       ? 
_citation.book_title                ? 
_citation.coordinate_linkage        ? 
_citation.country                   UK 
_citation.database_id_Medline       ? 
_citation.details                   ? 
_citation.id                        primary 
_citation.journal_abbrev            Structure 
_citation.journal_id_ASTM           STRUE6 
_citation.journal_id_CSD            2005 
_citation.journal_id_ISSN           0969-2126 
_citation.journal_full              ? 
_citation.journal_issue             ? 
_citation.journal_volume            34 
_citation.language                  ? 
_citation.page_first                133 
_citation.page_last                 ? 
_citation.title                     
'Structural basis of isethionate transport by a TRAP transporter from a sulfate-reducing bacterium.' 
_citation.year                      2026 
_citation.database_id_CSD           ? 
_citation.pdbx_database_id_DOI      10.1016/j.str.2025.10.011 
_citation.pdbx_database_id_PubMed   41197622 
_citation.pdbx_database_id_patent   ? 
_citation.unpublished_flag          ? 
# 
loop_
_citation_author.citation_id 
_citation_author.name 
_citation_author.ordinal 
_citation_author.identifier_ORCID 
primary 'Newton-Vesty, M.C.' 1  ? 
primary 'Scalise, M.'        2  ? 
primary 'Jamieson, S.A.'     3  ? 
primary 'Currie, M.J.'       4  ? 
primary 'Brown, H.G.'        5  ? 
primary 'Valimehr, S.'       6  ? 
primary 'Tillett, Z.D.'      7  ? 
primary 'Hall, K.R.'         8  ? 
primary 'Quan, S.'           9  ? 
primary 'Allison, J.R.'      10 ? 
primary 'Whitten, A.E.'      11 ? 
primary 'Panjikar, S.'       12 ? 
primary 'Indiveri, C.'       13 ? 
primary 'Hanssen, E.'        14 ? 
primary 'Mace, P.D.'         15 ? 
primary 'North, R.A.'        16 ? 
primary 'Dobson, R.C.J.'     17 ? 
primary 'Davies, J.S.'       18 ? 
# 
loop_
_entity.id 
_entity.type 
_entity.src_method 
_entity.pdbx_description 
_entity.formula_weight 
_entity.pdbx_number_of_molecules 
_entity.pdbx_ec 
_entity.pdbx_mutation 
_entity.pdbx_fragment 
_entity.details 
1 polymer     man 'Isethionate TRAP transporter permease protein DctMQ' 67592.578 1 ? ? ? ? 
2 polymer     man 'Megabody C7HopQ'                                     55463.898 1 ? ? ? ? 
3 non-polymer syn 'SODIUM ION'                                          22.990    1 ? ? ? ? 
4 non-polymer syn '2-hydroxyethylsulfonic acid'                         126.132   1 ? ? ? ? 
5 non-polymer syn PHOSPHATIDYLETHANOLAMINE                              734.039   3 ? ? ? ? 
# 
loop_
_entity_poly.entity_id 
_entity_poly.type 
_entity_poly.pdbx_seq_one_letter_code 
1 'polypeptide(L)' 
;MSDPNVTATIMNAQGECSSGSLESRPGILGWLDANFEKPFLVAGMLAIIFIITFQTLYRYIGVYLHEGAAAAVWTEEMAR

;
2 'polypeptide(L)' 
;QVSLQESGGGLVQTKTTTSVIDTTNDAQNLLTQAQTIVNTLKDYCPILIAKSSSSNGGTNNANTPSWQTAGGGKNSCATF
GAEFSAASDMINNAQKIVQETQQLSANQPKNITQPHNLNLNSPSSLTALAQKMLKNAQSQAEILKLANQVESDFNKLSSG
HLKDYIGKCDASAISSANMTMQNQKNNWGNGCAGVEETQSLLKTSAADFNNQTPQINQAQNLANTLIQELGNNTYEQLSR
LLTNDNGTNSKTSAQAINQAVNNLNERAKTLAGGTTNSPAYQATLLALRSVLGLWNSMGYAVICGGYTKSPGENNQKDFH
YTDENGNGTTINCGGSTNSNGTHSYNGTNTLKADKNVSLSIEQYEKIHEAYQILSKALKQAGLAPLNSKGEKLEAHVTTS
KYAGGSLRLSCAASGNIFLWANMGWYRQAPGKEREFVASISLGANTNYADSVKGRFTISRDNAKNTVYLQMNSLKQEDTA
VYYCAVWARYPSTYYLGRGYDYLYWGQGTQVTVSS
;
# 
loop_
_pdbx_entity_nonpoly.entity_id 
_pdbx_entity_nonpoly.name 
_pdbx_entity_nonpoly.comp_id 
3 'SODIUM ION'                  NA  
4 '2-hydroxyethylsulfonic acid' 8X3 
5 PHOSPHATIDYLETHANOLAMINE      PTY 
# 
loop_
_entity_src_gen.entity_id 
_entity_src_gen.pdbx_src_id 
_entity_src_gen.pdbx_alt_source_flag 
_entity_src_gen.pdbx_seq_type 
_entity_src_gen.pdbx_beg_seq_num 
_entity_src_gen.pdbx_end_seq_num 
_entity_src_gen.gene_src_common_name 
_entity_src_gen.gene_src_genus 
_entity_src_gen.pdbx_gene_src_gene 
_entity_src_gen.gene_src_species 
_entity_src_gen.gene_src_strain 
_entity_src_gen.gene_src_tissue 
_entity_src_gen.gene_src_tissue_fraction 
_entity_src_gen.gene_src_details 
_entity_src_gen.pdbx_gene_src_fragment 
_entity_src_gen.pdbx_gene_src_scientific_name 
_entity_src_gen.pdbx_gene_src_ncbi_taxonomy_id 
_entity_src_gen.pdbx_gene_src_variant 
_entity_src_gen.pdbx_gene_src_cell_line 
_entity_src_gen.pdbx_gene_src_atcc 
_entity_src_gen.pdbx_gene_src_culture_collection 
_entity_src_gen.pdbx_gene_src_organ 
_entity_src_gen.pdbx_gene_src_organelle 
_entity_src_gen.pdbx_gene_src_cell 
_entity_src_gen.pdbx_gene_src_cellular_location 
_entity_src_gen.host_org_common_name 
_entity_src_gen.pdbx_host_org_scientific_name 
_entity_src_gen.pdbx_host_org_ncbi_taxonomy_id 
_entity_src_gen.host_org_genus 
_entity_src_gen.pdbx_host_org_gene 
_entity_src_gen.pdbx_host_org_organ 
_entity_src_gen.host_org_species 
_entity_src_gen.pdbx_host_org_tissue 
_entity_src_gen.pdbx_host_org_tissue_fraction 
_entity_src_gen.pdbx_host_org_strain 
_entity_src_gen.pdbx_host_org_variant 
_entity_src_gen.pdbx_host_org_cell_line 
_entity_src_gen.pdbx_host_org_atcc 
_entity_src_gen.pdbx_host_org_culture_collection 
_entity_src_gen.pdbx_host_org_cell 
_entity_src_gen.pdbx_host_org_organelle 
_entity_src_gen.pdbx_host_org_cellular_location 
_entity_src_gen.pdbx_host_org_vector_type 
_entity_src_gen.pdbx_host_org_vector 
_entity_src_gen.host_org_details 
_entity_src_gen.expression_system_id 
_entity_src_gen.plasmid_name 
_entity_src_gen.plasmid_details 
_entity_src_gen.pdbx_description 
1 1 sample 'Biological sequence' 1 635 ? ? 'dctMQ, Dde_1274' ? ? ? ? ? ? 'Oleidesulfovibrio alaskensis G20' 207559 ? ? ? ? ? ? ? ? 
? 'Escherichia coli' 562 ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? 
2 1 sample 'Biological sequence' 1 515 ? ? ?                 ? ? ? ? ? ? 'Helicobacter pylori'              210    ? ? ? ? ? ? ? ? 
? 'Escherichia coli' 562 ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? 
# 
loop_
_chem_comp.id 
_chem_comp.type 
_chem_comp.mon_nstd_flag 
_chem_comp.name 
_chem_comp.pdbx_synonyms 
_chem_comp.formula 
_chem_comp.formula_weight 
8X3 non-polymer         . '2-hydroxyethylsulfonic acid' '2-oxidanylethanesulfonic acid' 'C2 H6 O4 S'     126.132 
ALA 'L-peptide linking' y ALANINE                       ?                               'C3 H7 N O2'     89.093  
ARG 'L-peptide linking' y ARGININE                      ?                               'C6 H15 N4 O2 1' 175.209 
ASN 'L-peptide linking' y ASPARAGINE                    ?                               'C4 H8 N2 O3'    132.118 
ASP 'L-peptide linking' y 'ASPARTIC ACID'               ?                               'C4 H7 N O4'     133.103 
CYS 'L-peptide linking' y CYSTEINE                      ?                               'C3 H7 N O2 S'   121.158 
GLN 'L-peptide linking' y GLUTAMINE                     ?                               'C5 H10 N2 O3'   146.144 
GLU 'L-peptide linking' y 'GLUTAMIC ACID'               ?                               'C5 H9 N O4'     147.129 
GLY 'peptide linking'   y GLYCINE                       ?                               'C2 H5 N O2'     75.067  
HIS 'L-peptide linking' y HISTIDINE                     ?                               'C6 H10 N3 O2 1' 156.162 
ILE 'L-peptide linking' y ISOLEUCINE                    ?                               'C6 H13 N O2'    131.173 
LEU 'L-peptide linking' y LEUCINE                       ?                               'C6 H13 N O2'    131.173 
LYS 'L-peptide linking' y LYSINE                        ?                               'C6 H15 N2 O2 1' 147.195 
MET 'L-peptide linking' y METHIONINE                    ?                               'C5 H11 N O2 S'  149.211 
NA  non-polymer         . 'SODIUM ION'                  ?                               'Na 1'           22.990  
PHE 'L-peptide linking' y PHENYLALANINE                 ?                               'C9 H11 N O2'    165.189 
PRO 'L-peptide linking' y PROLINE                       ?                               'C5 H9 N O2'     115.130 
PTY non-polymer         . PHOSPHATIDYLETHANOLAMINE      ?                               'C40 H80 N O8 P' 734.039 
SER 'L-peptide linking' y SERINE                        ?                               'C3 H7 N O3'     105.093 
THR 'L-peptide linking' y THREONINE                     ?                               'C4 H9 N O3'     119.119 
TRP 'L-peptide linking' y TRYPTOPHAN                    ?                               'C11 H12 N2 O2'  204.225 
TYR 'L-peptide linking' y TYROSINE                      ?                               'C9 H11 N O3'    181.189 
VAL 'L-peptide linking' y VALINE                        ?                               'C5 H11 N O2'    117.146 
# 
_exptl.entry_id         EMD-72036 
_exptl.details          ? 
_exptl.method           'ELECTRON MICROSCOPY' 
_exptl.method_details   ? 
# 
_struct_keywords.entry_id        EMD-72036 
_struct_keywords.text            'TRAP Transporter, Megabody, Isethionate, TRANSPORT PROTEIN' 
_struct_keywords.pdbx_keywords   'TRANSPORT PROTEIN' 
_struct_keywords.pdbx_details    ? 
# 
loop_
_struct_ref.id 
_struct_ref.db_name 
_struct_ref.db_code 
_struct_ref.entity_id 
1 UNP DCTMQ_OLEA2 1 
2 PDB 9PYM        2 
# 
_em_3d_fitting.id                1 
_em_3d_fitting.entry_id          EMD-72036 
_em_3d_fitting.method            ? 
_em_3d_fitting.target_criteria   ? 
_em_3d_fitting.details           ? 
_em_3d_fitting.overall_b_value   ? 
_em_3d_fitting.ref_space         ? 
_em_3d_fitting.ref_protocol      ? 
# 
_em_3d_reconstruction.entry_id                    EMD-72036 
_em_3d_reconstruction.id                          1 
_em_3d_reconstruction.method                      ? 
_em_3d_reconstruction.algorithm                   ? 
_em_3d_reconstruction.citation_id                 ? 
_em_3d_reconstruction.details                     ? 
_em_3d_reconstruction.resolution                  2.98 
_em_3d_reconstruction.resolution_method           'FSC 0.143 CUT-OFF' 
_em_3d_reconstruction.magnification_calibration   ? 
_em_3d_reconstruction.nominal_pixel_size          ? 
_em_3d_reconstruction.actual_pixel_size           ? 
_em_3d_reconstruction.num_particles               83854 
_em_3d_reconstruction.euler_angles_details        ? 
_em_3d_reconstruction.num_class_averages          ? 
_em_3d_reconstruction.fsc_type                    'EVEN/ODD MAPS REFINED TOTALLY INDEPENDENT (GOLD STANDARD)' 
_em_3d_reconstruction.refinement_type             ? 
_em_3d_reconstruction.image_processing_id         1 
_em_3d_reconstruction.symmetry_type               POINT 
# 
_em_buffer.id            1 
_em_buffer.specimen_id   1 
_em_buffer.name          ? 
_em_buffer.details       ? 
_em_buffer.pH            8 
# 
_em_entity_assembly.id                   1 
_em_entity_assembly.parent_id            0 
_em_entity_assembly.source               'MULTIPLE SOURCES' 
_em_entity_assembly.type                 COMPLEX 
_em_entity_assembly.name                 'IseQM complexed with Megabody C7HopQ' 
_em_entity_assembly.details              ? 
_em_entity_assembly.go_id                ? 
_em_entity_assembly.ipr_id               ? 
_em_entity_assembly.synonym              ? 
_em_entity_assembly.number_of_copies     ? 
_em_entity_assembly.oligomeric_details   ? 
_em_entity_assembly.entity_id_list       '1, 2' 
_em_entity_assembly.mutant_flag          ? 
_em_entity_assembly.chimera              NO 
# 
_em_imaging.entry_id                        EMD-72036 
_em_imaging.id                              1 
_em_imaging.astigmatism                     ? 
_em_imaging.electron_beam_tilt_params       ? 
_em_imaging.residual_tilt                   ? 
_em_imaging.sample_support_id               1 
_em_imaging.detector_id                     1 
_em_imaging.scans_id                        1 
_em_imaging.microscope_id                   ? 
_em_imaging.microscope_model                'TFS KRIOS' 
_em_imaging.specimen_holder_type            ? 
_em_imaging.specimen_holder_model           ? 
_em_imaging.details                         ? 
_em_imaging.date                            ? 
_em_imaging.accelerating_voltage            300 
_em_imaging.illumination_mode               'FLOOD BEAM' 
_em_imaging.mode                            'BRIGHT FIELD' 
_em_imaging.nominal_cs                      ? 
_em_imaging.nominal_defocus_min             800 
_em_imaging.nominal_defocus_max             1800 
_em_imaging.calibrated_defocus_min          ? 
_em_imaging.calibrated_defocus_max          ? 
_em_imaging.tilt_angle_min                  ? 
_em_imaging.tilt_angle_max                  ? 
_em_imaging.nominal_magnification           ? 
_em_imaging.calibrated_magnification        ? 
_em_imaging.electron_source                 'FIELD EMISSION GUN' 
_em_imaging.citation_id                     ? 
_em_imaging.temperature                     ? 
_em_imaging.detector_distance               ? 
_em_imaging.recording_temperature_minimum   ? 
_em_imaging.recording_temperature_maximum   ? 
_em_imaging.alignment_procedure             ? 
_em_imaging.c2_aperture_diameter            ? 
_em_imaging.specimen_id                     1 
_em_imaging.cryogen                         ? 
_em_imaging.objective_aperture              ? 
_em_imaging.microscope_serial_number        ? 
_em_imaging.microscope_version              ? 
# 
_em_vitrification.entry_id                EMD-72036 
_em_vitrification.id                      1 
_em_vitrification.sample_preparation_id   ? 
_em_vitrification.specimen_id             1 
_em_vitrification.cryogen_name            ETHANE 
_em_vitrification.humidity                ? 
_em_vitrification.temp                    ? 
_em_vitrification.chamber_temperature     ? 
_em_vitrification.instrument              ? 
_em_vitrification.method                  ? 
_em_vitrification.time_resolved_state     ? 
_em_vitrification.citation_id             ? 
_em_vitrification.details                 ? 
# 
_em_experiment.entry_id                EMD-72036 
_em_experiment.id                      1 
_em_experiment.reconstruction_method   'SINGLE PARTICLE' 
_em_experiment.aggregation_state       PARTICLE 
_em_experiment.entity_assembly_id      1 
# 
_em_admin.current_status        REL 
_em_admin.deposition_date       2025-08-07 
_em_admin.deposition_site       RCSB 
_em_admin.details               ? 
_em_admin.entry_id              EMD-72036 
_em_admin.last_update           2026-01-21 
_em_admin.map_release_date      2025-11-12 
_em_admin.header_release_date   2025-11-12 
_em_admin.obsoleted_date        ? 
_em_admin.title                 
'Cryo-EM structure of the isethionate TRAP transporter IseQM from Oleidesulfovibrio alaskensis with bound isethionate' 
_em_admin.process_site          RCSB 
_em_admin.composite_map         NO 
# 
loop_
_em_author_list.author 
_em_author_list.identifier_ORCID 
_em_author_list.ordinal 
'Newton-Vesty, M.C.' ? 1 
'Davies, J.S.'       ? 2 
'Dobson, R.C.J.'     ? 3 
# 
_em_ctf_correction.amplitude_correction              ? 
_em_ctf_correction.amplitude_correction_factor       ? 
_em_ctf_correction.amplitude_correction_space        ? 
_em_ctf_correction.correction_operation              ? 
_em_ctf_correction.details                           ? 
_em_ctf_correction.em_image_processing_id            1 
_em_ctf_correction.id                                1 
_em_ctf_correction.phase_reversal                    ? 
_em_ctf_correction.phase_reversal_anisotropic        ? 
_em_ctf_correction.phase_reversal_correction_space   ? 
_em_ctf_correction.type                              'PHASE FLIPPING AND AMPLITUDE CORRECTION' 
# 
_em_db_reference.access_code    9PYM 
_em_db_reference.db_name        PDB 
_em_db_reference.details        ? 
_em_db_reference.id             1 
_em_db_reference.relationship   'IN FRAME' 
# 
_em_entity_assembly_naturalsource.cell                 ? 
_em_entity_assembly_naturalsource.cellular_location    ? 
_em_entity_assembly_naturalsource.entity_assembly_id   1 
_em_entity_assembly_naturalsource.id                   2 
_em_entity_assembly_naturalsource.ncbi_tax_id          207559 
_em_entity_assembly_naturalsource.organism             'Oleidesulfovibrio alaskensis G20' 
_em_entity_assembly_naturalsource.organelle            ? 
_em_entity_assembly_naturalsource.organ                ? 
_em_entity_assembly_naturalsource.strain               ? 
_em_entity_assembly_naturalsource.tissue               ? 
_em_entity_assembly_naturalsource.details              ? 
# 
_em_entity_assembly_recombinant.cell                 ? 
_em_entity_assembly_recombinant.entity_assembly_id   1 
_em_entity_assembly_recombinant.id                   2 
_em_entity_assembly_recombinant.ncbi_tax_id          562 
_em_entity_assembly_recombinant.organism             'Escherichia coli' 
_em_entity_assembly_recombinant.plasmid              ? 
_em_entity_assembly_recombinant.strain               ? 
# 
loop_
_em_euler_angle_assignment.details 
_em_euler_angle_assignment.id 
_em_euler_angle_assignment.image_processing_id 
_em_euler_angle_assignment.order 
_em_euler_angle_assignment.proj_matching_angular_sampling 
_em_euler_angle_assignment.proj_matching_merit_function 
_em_euler_angle_assignment.proj_matching_num_projections 
_em_euler_angle_assignment.type 
? 1 1 INITIAL ? ? ? 'MAXIMUM LIKELIHOOD' 
? 2 1 FINAL   ? ? ? 'MAXIMUM LIKELIHOOD' 
# 
_em_image_processing.details              ? 
_em_image_processing.id                   1 
_em_image_processing.image_recording_id   1 
# 
_em_image_recording.average_exposure_time               ? 
_em_image_recording.avg_electron_dose_per_subtomogram   ? 
_em_image_recording.avg_electron_dose_per_image         66 
_em_image_recording.details                             ? 
_em_image_recording.detector_mode                       ? 
_em_image_recording.film_or_detector_model              'GATAN K3 BIOQUANTUM (6k x 4k)' 
_em_image_recording.id                                  1 
_em_image_recording.imaging_id                          1 
_em_image_recording.num_diffraction_images              ? 
_em_image_recording.num_grids_imaged                    ? 
_em_image_recording.num_real_images                     ? 
# 
loop_
_em_map.annotation_details 
_em_map.axis_order_fast 
_em_map.axis_order_medium 
_em_map.axis_order_slow 
_em_map.cell_a 
_em_map.cell_b 
_em_map.cell_c 
_em_map.cell_alpha 
_em_map.cell_beta 
_em_map.cell_gamma 
_em_map.contour_level 
_em_map.contour_level_source 
_em_map.data_type 
_em_map.dimensions_col 
_em_map.dimensions_row 
_em_map.dimensions_sec 
_em_map.endian_type 
_em_map.file 
_em_map.format 
_em_map.id 
_em_map.partition 
_em_map.entry_id 
_em_map.label 
_em_map.limit_col 
_em_map.limit_row 
_em_map.limit_sec 
_em_map.origin_col 
_em_map.origin_row 
_em_map.origin_sec 
_em_map.pixel_spacing_x 
_em_map.pixel_spacing_y 
_em_map.pixel_spacing_z 
_em_map.size_kb 
_em_map.spacing_x 
_em_map.spacing_y 
_em_map.spacing_z 
_em_map.statistics_average 
_em_map.statistics_maximum 
_em_map.statistics_minimum 
_em_map.statistics_std 
_em_map.symmetry_space_group 
_em_map.type 
'CryoSPARC unsharpened' X Y Z 255.6 255.6 255.6 90.0 90.0 90.0 0.075 author 'Image stored as floating point number (4 bytes)' 400 
400 400 big emd_72036.map.gz            CCP4 1 1 EMD-72036 ::::EMDATABANK.org::::EMD-72036:::: 399 399 399 0 0 0 0.639 0.639 0.639 
256001024 400 400 400 -6.374799E-4  0.34780687 -0.17036955 0.008470986 1 'primary map' 
'Half map B'            X Y Z 255.6 255.6 255.6 90.0 90.0 90.0 0.075 author 'Image stored as floating point number (4 bytes)' 400 
400 400 big emd_72036_half_map_2.map.gz CCP4 2 2 EMD-72036 ::::EMDATABANK.org::::EMD-72036:::: 399 399 399 0 0 0 0.639 0.639 0.639 
256001024 400 400 400 -1.4207044E-4 0.91470087 -0.88677293 0.10751787  1 'half map'    
'Half map A'            X Y Z 255.6 255.6 255.6 90.0 90.0 90.0 0.075 author 'Image stored as floating point number (4 bytes)' 400 
400 400 big emd_72036_half_map_1.map.gz CCP4 3 1 EMD-72036 ::::EMDATABANK.org::::EMD-72036:::: 399 399 399 0 0 0 0.639 0.639 0.639 
256001024 400 400 400 -1.6207703E-4 1.2891673  -1.2133956  0.15102255  1 'half map'    
# 
loop_
_em_software.category 
_em_software.details 
_em_software.id 
_em_software.image_processing_id 
_em_software.fitting_id 
_em_software.imaging_id 
_em_software.name 
_em_software.version 
_em_software.reference_DOI 
'PARTICLE SELECTION'            ? 1  1 ? ? cryoSPARC ? ? 
'IMAGE ACQUISITION'             ? 2  ? ? 1 ?         ? ? 
MASKING                         ? 3  ? ? ? ?         ? ? 
'CTF CORRECTION'                ? 4  1 ? ? ?         ? ? 
'LAYERLINE INDEXING'            ? 5  ? ? ? ?         ? ? 
'DIFFRACTION INDEXING'          ? 6  ? ? ? ?         ? ? 
'MODEL FITTING'                 ? 7  ? ? ? ?         ? ? 
'MODEL REFINEMENT'              ? 8  ? ? ? ?         ? ? 
OTHER                           ? 9  ? ? ? ?         ? ? 
'INITIAL EULER ASSIGNMENT'      ? 10 1 ? ? ?         ? ? 
'FINAL EULER ASSIGNMENT'        ? 11 1 ? ? ?         ? ? 
CLASSIFICATION                  ? 12 1 ? ? ?         ? ? 
RECONSTRUCTION                  ? 13 1 ? ? cryoSPARC ? ? 
'VOLUME SELECTION'              ? 14 1 1 1 ?         ? ? 
'SERIES ALIGNMENT'              ? 15 1 1 1 ?         ? ? 
'MOLECULAR REPLACEMENT'         ? 16 1 1 1 ?         ? ? 
'LATTICE DISTORTION CORRECTION' ? 17 1 1 1 ?         ? ? 
'SYMMETRY DETERMINATION'        ? 18 1 1 1 ?         ? ? 
'CRYSTALLOGRAPHY MERGING'       ? 19 1 1 1 ?         ? ? 
# 
_em_specimen.concentration           ? 
_em_specimen.details                 ? 
_em_specimen.embedding_applied       NO 
_em_specimen.experiment_id           1 
_em_specimen.id                      1 
_em_specimen.shadowing_applied       NO 
_em_specimen.staining_applied        NO 
_em_specimen.vitrification_applied   YES 
# 
_em_start_model.details                          ? 
_em_start_model.emdb_id                          ? 
_em_start_model.id                               1 
_em_start_model.image_processing_id              1 
_em_start_model.insilico_model                   ? 
_em_start_model.orthogonal_tilt_angle1           ? 
_em_start_model.orthogonal_tilt_angle2           ? 
_em_start_model.orthogonal_tilt_num_images       ? 
_em_start_model.other                            ? 
_em_start_model.pdb_id                           ? 
_em_start_model.random_conical_tilt_angle        ? 
_em_start_model.random_conical_tilt_num_images   ? 
_em_start_model.type                             'INSILICO MODEL' 
# 
_pdbx_audit_support.funding_organization   'Marsden Fund' 
_pdbx_audit_support.country                'New Zealand' 
_pdbx_audit_support.grant_number           ? 
_pdbx_audit_support.details                ? 
_pdbx_audit_support.ordinal                1 
# 
