SASDW33

STATIC-SAXS of Trypanosoma cruzi Prolyl Oligopepetidase (TcPOP)

Data type: SASBDB experimental data Status: Published Curve type: Extrapolated to infinite dilution Last updated: 2025-08-07T13:57:51.376271+02:00

CAUTION! Data are severely over subtracted. CAUTION! Severe aggregation. CAUTION! The Rg, I(0), particle size/volume, molecular weight, p(r) and any other structural parameters derived from the data are undefined/uninterpretable.

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1. Samples, Components and Experimental Conditions Sample & Experiment

Sample 1 · STATIC-SAXS of Trypanosoma cruzi Prolyl Oligopepetidase (TcPOP)

Concentration0.3 – 6.0 Buffer / pH20 mM HEPES, 150 mM NaCl / 7.4
Experimental temperature15.0 Facility / beamlineDiamond Light Source / B21
Wavelength0.09464 nmExposure1.0 s × 21

Molecular Components

ComponentType / organismUniProt and ConstructOligomeric StateMolecular weight
Prolyl endopeptidase
View sequence
>SP|Q71MD6|Q71MD6_TRYCR80KDAPROLYLOLIGOPEPTIDASEMRSVYPLARRSMAAYTMHNMTVPEPYDYLEDPENPETKTFVNEQNAFFEEYFASEAELRKKIFESISNSQDYPRTSNPSYINGHYYYYHNSGLQNQSVLMRAMSLTDTAPSIFLDPNSMSSDGTTALKATAWSEDESMLAYSLSDKGSDWQRIHVRRADTVEDTSDVIEWAKFTAIAWWHNLGFFYTRYPALQGDVDKGAETDAAQDAFICFHRIGRPQDEDVVILSVPEHPQWNMGASVSDCHSYVIVVLFDGCEPHNLVWVAELPSVEKGLGSEPLVFKKLVNEFAGRYTYLGNEGSTFYFVTTRDAPRKKIVSIDIHTGQETVIVEQQRSVLSQAALVKKTLLLAYLEDVKDVFYYCRLEDPTLNAIPLPIGTITSFFSDRKKDFVSFKITSFLLPGRSFFLDINDPQSSLRVFKDDTVEGLLVDDFVTEQTFYNSSDGVRIPMFIVYRKGSVSSESPLLLYGYGGFNIPLTPAFSSSRMVFLRDLGGVLAVLNIRGGGEYGEEWHDAGRRACKQNCFTDFIEGAKFLHRQGYGSPQTTAIMGGSNGGLLVAAVANQAPELFRCVVCRVGVLDMYKFHKFTIGHAWKSDYGDPEKEEDFRVLQQYSPLHNIKSGIKYPAILVVTGDHDDRVVPLHSLKYVATLQHMNPNEGGPFLARIEVAAGHGAGKPTSKILREAGDIYTFIAKNINASWKE
proteinTrypanosoma cruziQ71MD6—–—monomerMolecule count 178.335 kDa

Experimental Curves

CurvePoints / columnsq rangeUncertainty qualityNegative-intensity pointsSource file
12573[3]0.0045–0.34 1/AHas uncertainty columnMissing 0826sasbdb/entries/33/sasdw33/source/SASDW33.dat
▼

2. Measurements Reported by SASBDB Reported Results

MetricMethodValueUncertaintyUnit
dmaxP(r)0.03—Å
i0Guinier0.0417137—arbitrary
i0P(r)0.01332995—arbitrary
mwExperimental100.0—kDa
mwGuinier I(0)105.5—kDa
mwPorod106.0—kDa
porod_volumePorod170.0—ų
rgGuinier3.810.615Å
rgP(r)0.0—Å

These values are reported by SASBDB; SAXSdb did not recalculate them from the experimental curve.

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3. Source Fits and Models Source Fits & Models

This entry has no source fit record.

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4. Source File Index Source Files

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5. Experiment Description and Publication Experiment & Publication

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6. Complete Source Record Complete Source Record

The following content comes directly from the SASBDB entry. Missing values are shown as “—”; SAXSdb does not infer undeclared units.

Open the original SASBDB entry

Buffer and Sample Properties

Buffer name20 mM HEPES, 150 mM NaClBuffer concentration—
pH7.4Additives—
Buffer descriptionPurification buffer
Purity measurement method—Extinction coefficient—
Absorbance—Scattering contrast—
Specific volume / dry volume— / —Mixture / deuteration— / —

Acquisition Conditions and Instrument

Measurement date2023-04-24Storage / measurement temperature15.0 / 15.0
Exposure time1.0Frames21
Wavelength0.09464Sample-to-detector distance3.6856
SourceX-ray synchrotronDetectorEiger 4M
Facility / beamlineDiamond Light Source / B21 · Didcot, UK
q range0.045 – 3.4Sample volume / flow rate50.0 / 0.08

Original SASBDB Plots

Experimental I(q)
Experimental I(q)
Experimental I(q), log-log
Experimental I(q), log-log
Guinier plot
Guinier plot
Kratky plot
Kratky plot
P(r) plot
P(r) plot

Downloadable Files

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pddf:source record
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sascif:source record
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summary:source record
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All source fields (unfiltered)

Every source field is expanded here, including empty values, list members and fields already shown above.

summary.json:134 field values
Field pathRaw value
codeSASDW33
statusPublished
type_of_curveExtrapolated to infinite dilution
angular_unit1/A
project.titleCryo-EM led analysis of open and closed conformations of Chagas vaccine candidate TcPOP.
project.publication.titleCryo-EM led analysis of open and closed conformations of Chagas vaccine candidate TcPOP.
project.publication.author_listBatra S, Olmo F, Ragan TJ, Kaplan M, Calvaresi V, Frank AM, Lancey C, Assadipapari M, Ying C, Struwe WB, Hesketh EL, Kelly JM, Barfod L, Campeotto I
project.publication.journalNat Commun
project.publication.doi10.1038/s41467-025-62068-3
project.publication.pmid40764299
project.publication.published_date2025 Aug 5
project.statusreleased
project.submitted_date2024-12-07
project.released_date2025-08-07
pddf_datahttps://www.sasbdb.org/media/p_of_R_files/SASDW33.out
intensities_datahttps://www.sasbdb.org/media/intensities_files/SASDW33.dat
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pddf_plothttps://www.sasbdb.org/media/p_of_R_files/pofr_images/SASDW33_pofr_img.png
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sascif_datahttps://www.sasbdb.org/media/sascif/sascif_files/SASDW33.sascif
experiment.instrument.detector.typenull
experiment.instrument.detector.nameEiger 4M
experiment.instrument.detector.resolution75.0
experiment.instrument.nameDiamond Light Source
experiment.instrument.cityDidcot
experiment.instrument.countryUK
experiment.instrument.beamline_nameB21
experiment.instrument.beam_geometrynull
experiment.instrument.type_of_sourceX-ray synchrotron
experiment.instrument.point_sourcenull
experiment.instrument.line_collimationnull
experiment.instrument.sample_path_lengthnull
experiment.instrument.line_collimation_slitlengthnull
experiment.instrument.line_collimation_integrationwidthnull
experiment.instrument.xray_energynull
experiment.instrument.beam_profile_ahnull
experiment.instrument.beam_profile_alnull
experiment.sample.molecule[0].long_nameProlyl endopeptidase
experiment.sample.molecule[0].short_namenull
experiment.sample.molecule[0].sequence>sp|Q71MD6|Q71MD6_TRYCR 80 kDa prolyl oligopeptidase MRSVYPLARRSMAAYTMHNMTVPEPYDYLEDPENPETKTFVNEQNAFFEEYFASEAELRKKIFESISNSQ DYPRTSNPSYINGHYYYYHNSGLQNQSVLMRAMSLTDTAPSIFLDPNSMSSDGTTALKATAWSEDESMLA YSLSDKGSDWQRIHVRRADTVEDTSDVIEWAKFTAIAWWHNLGFFYTRYPALQGDVDKGAETDAAQDAFI CFHRIGRPQDEDVVILSVPEHPQWNMGASVSDCHSYVIVVLFDGCEPHNLVWVAELPSVEKGLGSEPLVF KKLVNEFAGRYTYLGNEGSTFYFVTTRDAPRKKIVSIDIHTGQETVIVEQQRSVLSQAALVKKTLLLAYL EDVKDVFYYCRLEDPTLNAIPLPIGTITSFFSDRKKDFVSFKITSFLLPGRSFFLDINDPQSSLRVFKDD TVEGLLVDDFVTEQTFYNSSDGVRIPMFIVYRKGSVSSESPLLLYGYGGFNIPLTPAFSSSRMVFLRDLG GVLAVLNIRGGGEYGEEWHDAGRRACKQNCFTDFIEGAKFLHRQGYGSPQTTAIMGGSNGGLLVAAVANQ APELFRCVVCRVGVLDMYKFHKFTIGHAWKSDYGDPEKEEDFRVLQQYSPLHNIKSGIKYPAILVVTGDH DDRVVPLHSLKYVATLQHMNPNEGGPFLARIEVAAGHGAGKPTSKILREAGDIYTFIAKNINASWKE
experiment.sample.molecule[0].organismTrypanosoma cruzi
experiment.sample.molecule[0].uniprot_codeQ71MD6
experiment.sample.molecule[0].uniprot_range_firstnull
experiment.sample.molecule[0].uniprot_range_lastnull
experiment.sample.molecule[0].oligomerizationmonomer
experiment.sample.molecule[0].molecular_typeprotein
experiment.sample.molecule[0].uniprot_sequenceMRSVYPLARRSMAAYTMHNMTVPEPYDYLEDPENPETKTFVNEQNAFFEEYFASEAELRK KIFESISNSQDYPRTSNPSYINGHYYYYHNSGLQNQSVLMRAMSLTDTAPSIFLDPNSMS SDGTTALKATAWSEDESMLAYSLSDKGSDWQRIHVRRADTVEDTSDVIEWAKFTAIAWWH NLGFFYTRYPALQGDVDKGAETDAAQDAFICFHRIGRPQDEDVVILSVPEHPQWNMGASV SDCHSYVIVVLFDGCEPHNLVWVAELPSVEKGLGSEPLVFKKLVNEFAGRYTYLGNEGST FYFVTTRDAPRKKIVSIDIHTGQETVIVEQQRSVLSQAALVKKTLLLAYLEDVKDVFYYC RLEDPTLNAIPLPIGTITSFFSDRKKDFVSFKITSFLLPGRSFFLDINDPQSSLRVFKDD TVEGLLVDDFVTEQTFYNSSDGVRIPMFIVYRKGSVSSESPLLLYGYGGFNIPLTPAFSS SRMVFLRDLGGVLAVLNIRGGGEYGEEWHDAGRRACKQNCFTDFIEGAKFLHRQGYGSPQ TTAIMGGSNGGLLVAAVANQAPELFRCVVCRVGVLDMYKFHKFTIGHAWKSDYGDPEKEE DFRVLQQYSPLHNIKSGIKYPAILVVTGDHDDRVVPLHSLKYVATLQHMNPNEGGPFLAR IEVAAGHGAGKPTSKILREAGDIYTFIAKNINASWKE
experiment.sample.molecule[0].mw78.335
experiment.sample.molecule[0].total_mw78.335
experiment.sample.molecule[0].number_molecules1
experiment.sample.molecule[0].complex_stateFalse
experiment.sample.molecule[0].deuterationnull
experiment.sample.molecule[0].molecule_sourcebiological
experiment.sample.molecule[0].molecule_description80 kDa prolyl oligopeptidase
experiment.sample.buffer.name20 mM HEPES, 150 mM NaCl
experiment.sample.buffer.concentration_unitnull
experiment.sample.buffer.commentPurification buffer
experiment.sample.buffer.additivenull
experiment.sample.buffer.concentrationnull
experiment.sample.buffer.pkanull
experiment.sample.buffer.ph7.4
experiment.sample.buffer.deuterationnull
experiment.sample.purity_methodnull
experiment.sample.nameSTATIC-SAXS of Trypanosoma cruzi Prolyl Oligopepetidase (TcPOP)
experiment.sample.ext_coefficientnull
experiment.sample.contrastnull
experiment.sample.specific_volnull
experiment.sample.dry_volnull
experiment.sample.absorbptionnull
experiment.sample.deuterationnull
experiment.sample.mixturenull
experiment.contributor[0].affiliation[0].short_namenull
experiment.contributor[0].affiliation[0].addressnull
experiment.contributor[0].affiliation[0].full_nameuniversity of nottingham
experiment.contributor[0].affiliation[0].webpagenull
experiment.contributor[0].contributor_nameIvan
experiment.contributor[0].contributor_surnameCampeotto
experiment.contributor[0].orcidhttps://orcid.org/0000-0002-0814-619X
experiment.concentration_methodnull
experiment.concentration_unitnull
experiment.date2023-04-24
experiment.storage_temperature15.0
experiment.cell_temperature15.0
experiment.exposure_time1.0
experiment.number_of_frames21
experiment.wavelength0.09464
experiment.sample_detector_distance3.6856
experiment.concentration_min0.3
experiment.concentration_max6.0
experiment.sample_volume50.0
experiment.flow_rate0.08
experiment.s_min0.045
experiment.s_max3.4
experiment.total_exposure_timenull
experiment.seccolumnnull
fits[]
estimated_volume_methodnull
pddf_softwareBioXTAS RAW
pddf_software_versionnull
i0_calibration_standardnull
descriptionCAUTION! Data are severely over subtracted. CAUTION! Severe aggregation. CAUTION! The Rg, I(0), particle size/volume, molecular weight, p(r) and any other structural parameters derived from the data are undefined/uninterpretable.
experiment_descriptionnull
tags[]
intensity_unitarbitrary
experimental_mw100.0
experimental_mw_errornull
guinier_i0_mw105.5
guinier_i0_mw_errornull
porod_mw106.0
porod_mw_errornull
pddf_i00.01332995
pddf_i0_errornull
guinier_i00.0417137
guinier_i0_errornull
pddf_rg0.0
pddf_rg_errornull
guinier_rg3.81
guinier_rg_error0.615
pddf_dmax0.03
pddf_dmax_errornull
porod_volume170.0
porod_volume_errornull
estimated_volumenull
estimated_volume_errornull
guinier_point_first155
guinier_point_last232
pddf_point_firstnull
pddf_point_lastnull
i0_calibration_standard_datanull
intensities_log_log_plotSASDW33_datloglog_img.png
symmetrynull
last_modified2025-08-07T13:57:51.376271+02:00
bragg_peak[]
manifest.json:34 field values
Field pathRaw value
codeSASDW33
statussuccess
started_at2026-08-11T13:51:47.636294+00:00
finished_at2026-08-11T13:51:59.691188+00:00
source_last_modified2025-08-07T13:57:51.376271+02:00
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View the complete summary.json source
{
  "code": "SASDW33",
  "status": "Published",
  "type_of_curve": "Extrapolated to infinite dilution",
  "angular_unit": "1/A",
  "project": {
    "title": "Cryo-EM led analysis of open and closed conformations of Chagas vaccine candidate TcPOP.",
    "publication": {
      "title": "Cryo-EM led analysis of open and closed conformations of Chagas vaccine candidate TcPOP.",
      "author_list": "Batra S, Olmo F, Ragan TJ, Kaplan M, Calvaresi V, Frank AM, Lancey C, Assadipapari M, Ying C, Struwe WB, Hesketh EL, Kelly JM, Barfod L, Campeotto I",
      "journal": "Nat Commun",
      "doi": "10.1038/s41467-025-62068-3",
      "pmid": "40764299",
      "published_date": "2025 Aug 5"
    },
    "status": "released",
    "submitted_date": "2024-12-07",
    "released_date": "2025-08-07"
  },
  "pddf_data": "https://www.sasbdb.org/media/p_of_R_files/SASDW33.out",
  "intensities_data": "https://www.sasbdb.org/media/intensities_files/SASDW33.dat",
  "intensities_log_plot": "https://www.sasbdb.org/media/intensities_files/scattering_plots/SASDW33_dat_img.png",
  "intensities_kratky_plot": "https://www.sasbdb.org/media/intensities_files/scattering_plots/SASDW33_kratky_img.png",
  "pddf_plot": "https://www.sasbdb.org/media/p_of_R_files/pofr_images/SASDW33_pofr_img.png",
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  "sascif_data": "https://www.sasbdb.org/media/sascif/sascif_files/SASDW33.sascif",
  "experiment": {
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      "detector": {
        "type": null,
        "name": "Eiger 4M",
        "resolution": 75.0
      },
      "name": "Diamond Light Source",
      "city": "Didcot",
      "country": "UK",
      "beamline_name": "B21",
      "beam_geometry": null,
      "type_of_source": "X-ray synchrotron",
      "point_source": null,
      "line_collimation": null,
      "sample_path_length": null,
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      "line_collimation_integrationwidth": null,
      "xray_energy": null,
      "beam_profile_ah": null,
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    },
    "sample": {
      "molecule": [
        {
          "long_name": "Prolyl endopeptidase",
          "short_name": null,
          "sequence": ">sp|Q71MD6|Q71MD6_TRYCR 80 kDa prolyl oligopeptidase\r\nMRSVYPLARRSMAAYTMHNMTVPEPYDYLEDPENPETKTFVNEQNAFFEEYFASEAELRKKIFESISNSQ\r\nDYPRTSNPSYINGHYYYYHNSGLQNQSVLMRAMSLTDTAPSIFLDPNSMSSDGTTALKATAWSEDESMLA\r\nYSLSDKGSDWQRIHVRRADTVEDTSDVIEWAKFTAIAWWHNLGFFYTRYPALQGDVDKGAETDAAQDAFI\r\nCFHRIGRPQDEDVVILSVPEHPQWNMGASVSDCHSYVIVVLFDGCEPHNLVWVAELPSVEKGLGSEPLVF\r\nKKLVNEFAGRYTYLGNEGSTFYFVTTRDAPRKKIVSIDIHTGQETVIVEQQRSVLSQAALVKKTLLLAYL\r\nEDVKDVFYYCRLEDPTLNAIPLPIGTITSFFSDRKKDFVSFKITSFLLPGRSFFLDINDPQSSLRVFKDD\r\nTVEGLLVDDFVTEQTFYNSSDGVRIPMFIVYRKGSVSSESPLLLYGYGGFNIPLTPAFSSSRMVFLRDLG\r\nGVLAVLNIRGGGEYGEEWHDAGRRACKQNCFTDFIEGAKFLHRQGYGSPQTTAIMGGSNGGLLVAAVANQ\r\nAPELFRCVVCRVGVLDMYKFHKFTIGHAWKSDYGDPEKEEDFRVLQQYSPLHNIKSGIKYPAILVVTGDH\r\nDDRVVPLHSLKYVATLQHMNPNEGGPFLARIEVAAGHGAGKPTSKILREAGDIYTFIAKNINASWKE",
          "organism": "Trypanosoma cruzi",
          "uniprot_code": "Q71MD6",
          "uniprot_range_first": null,
          "uniprot_range_last": null,
          "oligomerization": "monomer",
          "molecular_type": "protein",
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            "short_name": null,
            "address": null,
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            "webpage": null
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  "description": "CAUTION! Data are severely over subtracted. CAUTION! Severe aggregation. CAUTION! The Rg, I(0), particle size/volume, molecular weight, p(r) and any other structural parameters derived from the data are undefined/uninterpretable.",
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  "tags": [],
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  "last_modified": "2025-08-07T13:57:51.376271+02:00",
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}
View the complete manifest.json source
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