SASDDH6

Di-domain acyl carrier protein of the seryltransferase from prodigiosin biosynthesis

Data type: SASBDB experimental data Status: Published Curve type: Merged Last updated: 2024-10-17T15:41:17.447524+02:00

Two DAMMIF-derived dummy atom models are displayed. Top: The best-fit individual DAMMIF model and corresponding fit to the SAXS data. Bottom: The average spatial representation of the protein obtained after the alignment of multiple individual DAMMIF models combined with volume and bead-occupancy corrections (damfilt).

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1. Samples, Components and Experimental Conditions Sample & Experiment

Sample 1 · Di-domain acyl carrier protein of the seryltransferase from prodigiosin biosynthesis

Concentration1.7 – 6.8 Buffer / pH20 mM Tris supplemented with 5 mM DTT / 7.0
Experimental temperature25.0 Facility / beamlineSynchrotron Light Research Institute (SLRI) / BL1.3W
Wavelength0.131 nmExposure600.0 s × 1

Molecular Components

ComponentType / organismUniProt and ConstructOligomeric StateMolecular weight
Di-domain acyl carrier protein of PigH from prodigiosin biosynthesis
View sequence
>PIGHACP1ACP2GSHMNDVTTETYETLKQSVLHTFAQLTGYNVSELSLTSHLENDLGVDSIALAEIAVSLSRQFQLNTPLLIQDINTIKDALDGILQREFQLSEKVEPAAIALSGDADLWLGNLVRQIFASHSGYDVNALALDAEIESDLGIDSVSVASAQGELFNTLQLNSETIIANCNTLSALKQCLAARLVQEKGQDWFELTRAPPPPPLRSGC
proteinSerratia sp. ATCC 39006Q5W2644–191monomerMolecule count 122.209 kDa

Experimental Curves

CurvePoints / columnsq rangeUncertainty qualityNegative-intensity pointsSource file
1251[3]0.0410806–0.361182 1/AHas uncertainty columnMissing 00sasbdb/entries/h6/sasddh6/source/SASDDH6.dat
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2. Measurements Reported by SASBDB Reported Results

MetricMethodValueUncertaintyUnit
dmaxP(r)8.43—Å
i0Guinier2.2764e-051.6e-06arbitrary
i0P(r)2.343e-053.811e-06arbitrary
mwExperimental19.107—kDa
porod_volumePorod39.44—ų
rgGuinier2.390.18Å
rgP(r)2.560.36Å

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

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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 Tris supplemented with 5 mM DTTBuffer concentration—
pH7.0Additives—
Buffer description—
Purity measurement method—Extinction coefficient—
Absorbance—Scattering contrast—
Specific volume / dry volume— / —Mixture / deuteration— / —

Acquisition Conditions and Instrument

Measurement date2016-01-13Storage / measurement temperature25.0 / 25.0
Exposure time600.0Frames1
Wavelength0.131Sample-to-detector distance0.85
SourceX-ray synchrotronDetectorRayonix SX165
Facility / beamlineSynchrotron Light Research Institute (SLRI) / BL1.3W · Nakhon Ratchasima, Thailand
q range0.411 – 3.612Sample volume / flow rate— / —

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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full_entry_zip:source record and ZIP contents (5 items)
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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:169 field values
Field pathRaw value
codeSASDDH6
statusPublished
type_of_curveMerged
angular_unit1/A
project.titleSolution Structure and Conformational Dynamics of a Doublet Acyl Carrier Protein from Prodigiosin Biosynthesis.
project.publication.titleSolution Structure and Conformational Dynamics of a Doublet Acyl Carrier Protein from Prodigiosin Biosynthesis.
project.publication.author_listThongkawphueak T, Winter AJ, Williams C, Maple HJ, Soontaranon S, Kaewhan C, Campopiano DJ, Crump MP, Wattana-Amorn P
project.publication.journalBiochemistry
project.publication.doi10.1021/acs.biochem.0c00830
project.publication.pmid33416314
project.publication.published_date2021 Jan 8
project.statusreleased
project.submitted_date2018-05-10
project.released_date2020-03-25
pddf_datahttps://www.sasbdb.org/media/p_of_R_files/SASDDH6.out
intensities_datahttps://www.sasbdb.org/media/intensities_files/SASDDH6.dat
intensities_log_plothttps://www.sasbdb.org/media/intensities_files/scattering_plots/SASDDH6_dat_img.png
intensities_kratky_plothttps://www.sasbdb.org/media/intensities_files/scattering_plots/SASDDH6_kratky_img.png
pddf_plothttps://www.sasbdb.org/media/p_of_R_files/pofr_images/SASDDH6_pofr_img.png
intensities_guinier_plothttps://www.sasbdb.org/media/intensities_files/scattering_plots/SASDDH6_guinier_img.png
sascif_datahttps://www.sasbdb.org/media/sascif/sascif_files/SASDDH6.sascif
experiment.instrument.detector.typeCCD
experiment.instrument.detector.nameRayonix SX165
experiment.instrument.detector.resolution15.0
experiment.instrument.nameSynchrotron Light Research Institute (SLRI)
experiment.instrument.cityNakhon Ratchasima
experiment.instrument.countryThailand
experiment.instrument.beamline_nameBL1.3W
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_nameDi-domain acyl carrier protein of PigH from prodigiosin biosynthesis
experiment.sample.molecule[0].short_nameDi-domain ACP
experiment.sample.molecule[0].sequence>PigHACP1ACP2 GSHMNDVTTETYETLKQSVLHTFAQLTGYNVSELSLTSHLENDLGVDSIALAEIAVSLSRQFQLNTPLLIQDINTIKDALDGILQREFQLSEKVEPAAIALSGDADLWLGNLVRQIFASHSGYDVNALALDAEIESDLGIDSVSVASAQGELFNTLQLNSETIIANCNTLSALKQCLAARLVQEKGQDWFELTRAPPPPPLRSGC
experiment.sample.molecule[0].organismSerratia sp. ATCC 39006
experiment.sample.molecule[0].uniprot_codeQ5W264
experiment.sample.molecule[0].uniprot_range_first4
experiment.sample.molecule[0].uniprot_range_last191
experiment.sample.molecule[0].oligomerizationmonomer
experiment.sample.molecule[0].molecular_typeprotein
experiment.sample.molecule[0].uniprot_sequenceMNDVTTETYETLKQSVLHTFAQLTGYNVSELSLTSHLENDLGVDSIALAEIAVSLSRQFQ LNTPLLIQDINTIKDALDGILQREFQLSEKVEPAAIALSGDADLWLGNLVRQIFASHSGY DVNALALDAEIESDLGIDSVSVASAQGELFNTLQLNSETIIANCNTLSALKQCLAARLVQ EKGQDWFEQRGRGQSDSAIDHDADTTAEVTPPTATPVAINAEIGDPRTMRDFVGIEHPDI FHKAREFHLFYQDKKKRQLYFYGMPLETPCKNRAVMFDEATGQHREFLMFGSNSYLGLSN HPEIIHAIQDAASLYGATNTGCRIIAGSNVLHLELERKLAKLKGRDDCIVYPSGYSANLG CISALTSRHDLVFTDAINHMSIQDGCKLAGAQRKIYNHSLTSLEKSLAKYADHPGGKLIV TDGVFSMHGDIVDLPRLMKLAERYGARVLVDDAHSTGVLGKTGAGTSEHFNMKGQVDLEL GTMSKALSGLGGYVCGDGDVVEYLRFYSNSYVFAATIPAPVAAGVIASIDVMLREPERLA KLWDNIYYFRTRLLNAGFDLENSDSAIIPIVVGDDAKTLFFGRAVRARGMFCQTVVFPGV SVGDARLRISITSEHTREDLDEAYAILVASALEVGVPVNASAHQEENASVAEA
experiment.sample.molecule[0].mw22.209
experiment.sample.molecule[0].total_mw22.209
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_descriptionnull
experiment.sample.buffer.name20 mM Tris supplemented with 5 mM DTT
experiment.sample.buffer.concentration_unitnull
experiment.sample.buffer.commentnull
experiment.sample.buffer.additivenull
experiment.sample.buffer.concentrationnull
experiment.sample.buffer.pkanull
experiment.sample.buffer.ph7.0
experiment.sample.buffer.deuterationnull
experiment.sample.purity_methodnull
experiment.sample.nameDi-domain acyl carrier protein of the seryltransferase from prodigiosin biosynthesis
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].addressThailand
experiment.contributor[0].affiliation[0].full_nameKasetsart University
experiment.contributor[0].affiliation[0].webpagehttps://www.ku.ac.th
experiment.contributor[0].contributor_namePakorn
experiment.contributor[0].contributor_surnameWattana-Amorn
experiment.contributor[0].orcidnull
experiment.concentration_methodnull
experiment.concentration_unitnull
experiment.date2016-01-13
experiment.storage_temperature25.0
experiment.cell_temperature25.0
experiment.exposure_time600.0
experiment.number_of_frames1
experiment.wavelength0.131
experiment.sample_detector_distance0.85
experiment.concentration_min1.7
experiment.concentration_max6.8
experiment.sample_volumenull
experiment.flow_ratenull
experiment.s_min0.411
experiment.s_max3.612
experiment.total_exposure_timenull
experiment.seccolumnnull
fits[0].models[0].model_plothttps://www.sasbdb.org/media/pdb_file/images/SASDDH6_fit1_model1_img.png
fits[0].models[0].softwareDAMMIF
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fits[0].models[0].bead_radius1.8
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fits[0].models[0].commentnull
fits[0].models[0].user318
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fits[0].models[1].symmetrynull
fits[0].models[1].commentnull
fits[0].models[1].user318
fits[0].fit_unit1/A
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fits[0].softwareDAMMIF
fits[0].chi_square_value2.864
fits[0].p_value0.3102
fits[0].fit_residual_plotSASDDH6_fit1_fitresiduals_img.png
fits[0].fit_datahttps://www.sasbdb.org/media/fitting_files/SASDDH6_fit1.fir
fits[0].fit_loghttps://www.sasbdb.org/media/fitting_files/log_files/run_1_alDHk3F.log
fits[0].software_versionnull
fits[0].descriptionnull
estimated_volume_methodnull
pddf_softwareATSAS GNOM
pddf_software_version4.5a
i0_calibration_standardnull
descriptionTwo DAMMIF-derived dummy atom models are displayed. Top: The best-fit individual DAMMIF model and corresponding fit to the SAXS data. Bottom: The average spatial representation of the protein obtained after the alignment of multiple individual DAMMIF models combined with volume and bead-occupancy corrections (damfilt).
experiment_descriptionSynchrotron SAXS data from solutions of the di-domain acyl carrier protein of the seryltransferase from prodigiosin biosynthesis in 20 mM Tris, 5 mM DTT, pH 7, were collected on the BL1.3W beam line at the Synchrotron Light Research Institute (Nakhon Ratchasima, Thailand) using a CCD Rayonix SX165 detector at a sample-detector distance of 0.9 m and at a wavelength of λ = 0.131 nm (l(s) vs s, where s = 4πsinθ/λ, and 2θ is the scattering angle). Solute concentrations ranging between 1.7 and 6.8 mg/ml were measured at 25°C. One 600 second frame was collected. The data were normalized to the intensity of the transmitted beam and radially averaged; the scattering of the solvent-blank was subtracted. The low angle data collected at lower concentration were merged with the highest concentration high angle data to yield the final composite scattering curve.
tags[]
intensity_unitarbitrary
experimental_mw19.107
experimental_mw_errornull
guinier_i0_mwnull
guinier_i0_mw_errornull
porod_mwnull
porod_mw_errornull
pddf_i02.343e-05
pddf_i0_error3.811e-06
guinier_i02.2764e-05
guinier_i0_error1.6e-06
pddf_rg2.56
pddf_rg_error0.36
guinier_rg2.39
guinier_rg_error0.18
pddf_dmax8.43
pddf_dmax_errornull
porod_volume39.44
porod_volume_errornull
estimated_volumenull
estimated_volume_errornull
guinier_point_first2
guinier_point_last11
pddf_point_firstnull
pddf_point_lastnull
i0_calibration_standard_datanull
intensities_log_log_plotSASDDH6_datloglog_img.png
symmetrynull
last_modified2024-10-17T15:41:17.447524+02:00
bragg_peak[]
manifest.json:36 field values
Field pathRaw value
codeSASDDH6
statussuccess
started_at2026-08-11T15:10:14.313395+00:00
finished_at2026-08-11T15:10:22.477500+00:00
source_last_modified2024-10-17T15:41:17.447524+02:00
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View the complete summary.json source
{
  "code": "SASDDH6",
  "status": "Published",
  "type_of_curve": "Merged",
  "angular_unit": "1/A",
  "project": {
    "title": "Solution Structure and Conformational Dynamics of a Doublet Acyl Carrier Protein from Prodigiosin Biosynthesis.",
    "publication": {
      "title": "Solution Structure and Conformational Dynamics of a Doublet Acyl Carrier Protein from Prodigiosin Biosynthesis.",
      "author_list": "Thongkawphueak T, Winter AJ, Williams C, Maple HJ, Soontaranon S, Kaewhan C, Campopiano DJ, Crump MP, Wattana-Amorn P",
      "journal": "Biochemistry",
      "doi": "10.1021/acs.biochem.0c00830",
      "pmid": "33416314",
      "published_date": "2021 Jan 8"
    },
    "status": "released",
    "submitted_date": "2018-05-10",
    "released_date": "2020-03-25"
  },
  "pddf_data": "https://www.sasbdb.org/media/p_of_R_files/SASDDH6.out",
  "intensities_data": "https://www.sasbdb.org/media/intensities_files/SASDDH6.dat",
  "intensities_log_plot": "https://www.sasbdb.org/media/intensities_files/scattering_plots/SASDDH6_dat_img.png",
  "intensities_kratky_plot": "https://www.sasbdb.org/media/intensities_files/scattering_plots/SASDDH6_kratky_img.png",
  "pddf_plot": "https://www.sasbdb.org/media/p_of_R_files/pofr_images/SASDDH6_pofr_img.png",
  "intensities_guinier_plot": "https://www.sasbdb.org/media/intensities_files/scattering_plots/SASDDH6_guinier_img.png",
  "sascif_data": "https://www.sasbdb.org/media/sascif/sascif_files/SASDDH6.sascif",
  "experiment": {
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      "detector": {
        "type": "CCD",
        "name": "Rayonix SX165",
        "resolution": 15.0
      },
      "name": "Synchrotron Light Research Institute (SLRI)",
      "city": "Nakhon Ratchasima",
      "country": "Thailand",
      "beamline_name": "BL1.3W",
      "beam_geometry": null,
      "type_of_source": "X-ray synchrotron",
      "point_source": null,
      "line_collimation": null,
      "sample_path_length": null,
      "line_collimation_slitlength": null,
      "line_collimation_integrationwidth": null,
      "xray_energy": null,
      "beam_profile_ah": null,
      "beam_profile_al": null
    },
    "sample": {
      "molecule": [
        {
          "long_name": "Di-domain acyl carrier protein of PigH from prodigiosin biosynthesis",
          "short_name": "Di-domain ACP",
          "sequence": ">PigHACP1ACP2\r\nGSHMNDVTTETYETLKQSVLHTFAQLTGYNVSELSLTSHLENDLGVDSIALAEIAVSLSRQFQLNTPLLIQDINTIKDALDGILQREFQLSEKVEPAAIALSGDADLWLGNLVRQIFASHSGYDVNALALDAEIESDLGIDSVSVASAQGELFNTLQLNSETIIANCNTLSALKQCLAARLVQEKGQDWFELTRAPPPPPLRSGC",
          "organism": "Serratia sp. ATCC 39006",
          "uniprot_code": "Q5W264",
          "uniprot_range_first": 4,
          "uniprot_range_last": 191,
          "oligomerization": "monomer",
          "molecular_type": "protein",
          "uniprot_sequence": "MNDVTTETYETLKQSVLHTFAQLTGYNVSELSLTSHLENDLGVDSIALAEIAVSLSRQFQ\nLNTPLLIQDINTIKDALDGILQREFQLSEKVEPAAIALSGDADLWLGNLVRQIFASHSGY\nDVNALALDAEIESDLGIDSVSVASAQGELFNTLQLNSETIIANCNTLSALKQCLAARLVQ\nEKGQDWFEQRGRGQSDSAIDHDADTTAEVTPPTATPVAINAEIGDPRTMRDFVGIEHPDI\nFHKAREFHLFYQDKKKRQLYFYGMPLETPCKNRAVMFDEATGQHREFLMFGSNSYLGLSN\nHPEIIHAIQDAASLYGATNTGCRIIAGSNVLHLELERKLAKLKGRDDCIVYPSGYSANLG\nCISALTSRHDLVFTDAINHMSIQDGCKLAGAQRKIYNHSLTSLEKSLAKYADHPGGKLIV\nTDGVFSMHGDIVDLPRLMKLAERYGARVLVDDAHSTGVLGKTGAGTSEHFNMKGQVDLEL\nGTMSKALSGLGGYVCGDGDVVEYLRFYSNSYVFAATIPAPVAAGVIASIDVMLREPERLA\nKLWDNIYYFRTRLLNAGFDLENSDSAIIPIVVGDDAKTLFFGRAVRARGMFCQTVVFPGV\nSVGDARLRISITSEHTREDLDEAYAILVASALEVGVPVNASAHQEENASVAEA",
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          "complex_state": false,
          "deuteration": null,
          "molecule_source": "biological",
          "molecule_description": null
        }
      ],
      "buffer": {
        "name": "20 mM Tris supplemented with 5 mM DTT",
        "concentration_unit": null,
        "comment": null,
        "additive": null,
        "concentration": null,
        "pka": null,
        "ph": 7.0,
        "deuteration": null
      },
      "purity_method": null,
      "name": "Di-domain acyl carrier protein of the seryltransferase from prodigiosin biosynthesis",
      "ext_coefficient": null,
      "contrast": null,
      "specific_vol": null,
      "dry_vol": null,
      "absorbption": null,
      "deuteration": null,
      "mixture": null
    },
    "contributor": [
      {
        "affiliation": [
          {
            "short_name": null,
            "address": "Thailand",
            "full_name": "Kasetsart University",
            "webpage": "https://www.ku.ac.th"
          }
        ],
        "contributor_name": "Pakorn",
        "contributor_surname": "Wattana-Amorn",
        "orcid": null
      }
    ],
    "concentration_method": null,
    "concentration_unit": null,
    "date": "2016-01-13",
    "storage_temperature": 25.0,
    "cell_temperature": 25.0,
    "exposure_time": 600.0,
    "number_of_frames": 1,
    "wavelength": 0.131,
    "sample_detector_distance": 0.85,
    "concentration_min": 1.7,
    "concentration_max": 6.8,
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    "flow_rate": null,
    "s_min": 0.411,
    "s_max": 3.612,
    "total_exposure_time": null,
    "seccolumn": null
  },
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    {
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        {
          "model_plot": "https://www.sasbdb.org/media/pdb_file/images/SASDDH6_fit1_model1_img.png",
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          "pdb_link": [],
          "model_title": null,
          "type_of_model": "dummy",
          "software_version": "r6669",
          "model_data": "https://www.sasbdb.org/media/pdb_file/SASDDH6_fit1_model1.pdb",
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          "user": 318
        },
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      "fit_residual_plot": "SASDDH6_fit1_fitresiduals_img.png",
      "fit_data": "https://www.sasbdb.org/media/fitting_files/SASDDH6_fit1.fir",
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  "guinier_i0": 2.2764e-05,
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  "i0_calibration_standard_data": null,
  "intensities_log_log_plot": "SASDDH6_datloglog_img.png",
  "symmetry": null,
  "last_modified": "2024-10-17T15:41:17.447524+02:00",
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}
View the complete manifest.json source
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