SASDUZ4

Calcium/calmodulin-dependent protein kinase type II alpha (CaMKIIα) W403L hub domain

Data type: SASBDB experimental data Status: Published Curve type: Single concentration Last updated: 2024-09-18T12:55:13.625515+02:00

Single point mutant for comparison with the WT hub.

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1. Samples, Components and Experimental Conditions Sample & Experiment

Sample 1 · Calcium/calmodulin-dependent protein kinase type II alpha (CaMKIIα) W403L hub domain

Concentration— – 6.4 Buffer / pH20 mM MES, 150 mM NaCl, 1 mM DTT / 6.0
Experimental temperature20.0 Facility / beamlinePETRA III / EMBL P12
Wavelength0.124 nmExposure0.095 s × 30

Molecular Components

ComponentType / organismUniProt and ConstructOligomeric StateMolecular weight
Calcium/calmodulin-dependent protein kinase type II subunit alpha (W403L)
View sequence
GPHMVRKQEIIKVTEQLIEAISNGDFESYTKMCDPGMTAFEPEALGNLVEGLDFHRFYFENLLSRNSKPVHTTILNPHIHLMGDESACIAYIRITQYLDAGGIPRTAQSEETRVWHRRDGKWQIVHFHRSGAPSV
proteinHomo sapiensQ9UQM7345–475dodecamerMolecule count 1215.404 kDa

Experimental Curves

CurvePoints / columnsq rangeUncertainty qualityNegative-intensity pointsSource file
11539[3]0.0202521–4.46994 1/nmHas uncertainty columnMissing 01sasbdb/entries/z4/sasduz4/source/SASDUZ4.dat
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2. Measurements Reported by SASBDB Reported Results

MetricMethodValueUncertaintyUnit
dmaxP(r)16.5—nm
i0Guinier0.20841—1/cm
i0P(r)0.2064—1/cm
mwExperimental186.0—kDa
mwPorod223.0—kDa
porod_volumePorod357.5—nm³
rgGuinier4.670.017nm
rgP(r)4.603—nm

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 MES, 150 mM NaCl, 1 mM DTTBuffer concentration—
pH6.0Additives—
Buffer description—
Purity measurement method—Extinction coefficient—
Absorbance—Scattering contrast—
Specific volume / dry volume— / —Mixture / deuteration— / —

Acquisition Conditions and Instrument

Measurement date2023-03-17Storage / measurement temperature10.0 / 20.0
Exposure time0.095Frames30
Wavelength0.124Sample-to-detector distance3.0
SourceX-ray synchrotronDetectorPilatus 6M
Facility / beamlinePETRA III / EMBL P12 · DESY; Hamburg, Germany
q range0.02 – 4.47Sample 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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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
codeSASDUZ4
statusPublished
type_of_curveSingle concentration
angular_unit1/nm
project.titleLigand‐induced <scp>CaMKIIα</scp> hub Trp403 flip, hub domain stacking, and modulation of kinase activity
project.publication.titleLigand‐induced <scp>CaMKIIα</scp> hub Trp403 flip, hub domain stacking, and modulation of kinase activity
project.publication.author_listNarayanan D, Larsen A, Gauger S, Adafia R, Hammershøi R, Hamborg L, Bruus‐Jensen J, Griem‐Krey N, Gee C, Frølund B, Stratton M, Kuriyan J, Kastrup J, Langkilde A, Wellendorph P, Solbak S
project.publication.journalProtein Science
project.publication.doi10.1002/pro.5152
project.publication.pmidnull
project.publication.published_date2024 Sep 14
project.statusreleased
project.submitted_date2024-03-18
project.released_date2024-09-18
pddf_datahttps://www.sasbdb.org/media/p_of_R_files/SASDUZ4.out
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pddf_plothttps://www.sasbdb.org/media/p_of_R_files/pofr_images/SASDUZ4_pofr_img.png
intensities_guinier_plothttps://www.sasbdb.org/media/intensities_files/scattering_plots/SASDUZ4_guinier_img.png
sascif_datahttps://www.sasbdb.org/media/sascif/sascif_files/SASDUZ4.sascif
experiment.instrument.detector.typenull
experiment.instrument.detector.namePilatus 6M
experiment.instrument.detector.resolutionnull
experiment.instrument.namePETRA III
experiment.instrument.cityDESY; Hamburg
experiment.instrument.countryGermany
experiment.instrument.beamline_nameEMBL P12
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_nameCalcium/calmodulin-dependent protein kinase type II subunit alpha (W403L)
experiment.sample.molecule[0].short_nameCaMKIIα W403L hub
experiment.sample.molecule[0].sequenceGPHMVRKQEIIKVTEQLIEAISNGDFESYTKMCDPGMTAFEPEALGNLVEGLDFHRFYFENLLSRNSKPVHTTILNPHIHLMGDESACIAYIRITQYLDAGGIPRTAQSEETRVWHRRDGKWQIVHFHRSGAPSV
experiment.sample.molecule[0].organismHomo sapiens
experiment.sample.molecule[0].uniprot_codeQ9UQM7
experiment.sample.molecule[0].uniprot_range_first345
experiment.sample.molecule[0].uniprot_range_last475
experiment.sample.molecule[0].oligomerizationdodecamer
experiment.sample.molecule[0].molecular_typeprotein
experiment.sample.molecule[0].uniprot_sequenceMATITCTRFTEEYQLFEELGKGAFSVVRRCVKVLAGQEYAAKIINTKKLSARDHQKLERE ARICRLLKHPNIVRLHDSISEEGHHYLIFDLVTGGELFEDIVAREYYSEADASHCIQQIL EAVLHCHQMGVVHRDLKPENLLLASKLKGAAVKLADFGLAIEVEGEQQAWFGFAGTPGYL SPEVLRKDPYGKPVDLWACGVILYILLVGYPPFWDEDQHRLYQQIKAGAYDFPSPEWDTV TPEAKDLINKMLTINPSKRITAAEALKHPWISHRSTVASCMHRQETVDCLKKFNARRKLK GAILTTMLATRNFSGGKSGGNKKSDGVKESSESTNTTIEDEDTKVRKQEIIKVTEQLIEA ISNGDFESYTKMCDPGMTAFEPEALGNLVEGLDFHRFYFENLWSRNSKPVHTTILNPHIH LMGDESACIAYIRITQYLDAGGIPRTAQSEETRVWHRRDGKWQIVHFHRSGAPSVLPH
experiment.sample.molecule[0].mw15.404
experiment.sample.molecule[0].total_mw184.848
experiment.sample.molecule[0].number_molecules12
experiment.sample.molecule[0].complex_stateFalse
experiment.sample.molecule[0].deuterationnull
experiment.sample.molecule[0].molecule_sourcebiological
experiment.sample.molecule[0].molecule_descriptionW403L mutant of the WT hub domain. The protein construct used for SAXS contains an additional four non-native amino acids at the N-terminus (GPHM).
experiment.sample.buffer.name20 mM MES, 150 mM NaCl, 1 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.ph6.0
experiment.sample.buffer.deuterationnull
experiment.sample.purity_methodnull
experiment.sample.nameCalcium/calmodulin-dependent protein kinase type II alpha (CaMKIIα) W403L hub domain
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].addressCopenhagen, Denmark
experiment.contributor[0].affiliation[0].full_nameUniversity of Copenhagen
experiment.contributor[0].affiliation[0].webpagehttp://www.ku.dk/
experiment.contributor[0].contributor_nameAnnette
experiment.contributor[0].contributor_surnameLangkilde
experiment.contributor[0].orcid
experiment.concentration_methodnull
experiment.concentration_unitnull
experiment.date2023-03-17
experiment.storage_temperature10.0
experiment.cell_temperature20.0
experiment.exposure_time0.095
experiment.number_of_frames30
experiment.wavelength0.124
experiment.sample_detector_distance3.0
experiment.concentration_minnull
experiment.concentration_max6.4
experiment.sample_volumenull
experiment.flow_ratenull
experiment.s_min0.02
experiment.s_max4.47
experiment.total_exposure_timenull
experiment.seccolumnnull
fits[]
estimated_volume_methodnull
pddf_softwareATSAS GNOM
pddf_software_version5.0
i0_calibration_standardnull
descriptionSingle point mutant for comparison with the WT hub.
experiment_descriptionSynchrotron SAXS data from solutions of calcium/calmodulin-dependent protein kinase type II alpha (CaMKIIα) W403L hub domain in 20 mM MES, 150 mM NaCl, 1 mM DTT, pH 6 were collected on the EMBL P12 beam line at PETRA III (DESY; Hamburg, Germany) using a Pilatus 6M detector at a sample-detector distance of 3 m and at a wavelength of λ = 0.124 nm (I(s) vs s, where s = 4πsinθ/λ, and 2θ is the scattering angle). One solute concentration of 6.40 mg/ml was measured at 20°C. 30 successive 0.095 second frames were collected. The data were normalized to the intensity of the transmitted beam and radially averaged; the scattering of the solvent-blank was subtracted.
tags[]
intensity_unit1/cm
experimental_mw186.0
experimental_mw_errornull
guinier_i0_mwnull
guinier_i0_mw_errornull
porod_mw223.0
porod_mw_errornull
pddf_i00.2064
pddf_i0_errornull
guinier_i00.20841
guinier_i0_errornull
pddf_rg4.603
pddf_rg_errornull
guinier_rg4.67
guinier_rg_error0.017
pddf_dmax16.5
pddf_dmax_errornull
porod_volume357.5
porod_volume_errornull
estimated_volumenull
estimated_volume_errornull
guinier_point_first15
guinier_point_last70
pddf_point_firstnull
pddf_point_lastnull
i0_calibration_standard_datanull
intensities_log_log_plotSASDUZ4_datloglog_img.png
symmetrynull
last_modified2024-09-18T12:55:13.625515+02:00
bragg_peak[]
manifest.json:34 field values
Field pathRaw value
codeSASDUZ4
statussuccess
started_at2026-08-11T14:35:31.371864+00:00
finished_at2026-08-11T14:35:38.893057+00:00
source_last_modified2024-09-18T12:55:13.625515+02:00
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View the complete summary.json source
{
  "code": "SASDUZ4",
  "status": "Published",
  "type_of_curve": "Single concentration",
  "angular_unit": "1/nm",
  "project": {
    "title": "Ligand‐induced <scp>CaMKIIα</scp>\n              hub Trp403 flip, hub domain stacking, and modulation of kinase activity",
    "publication": {
      "title": "Ligand‐induced <scp>CaMKIIα</scp>\n              hub Trp403 flip, hub domain stacking, and modulation of kinase activity",
      "author_list": "Narayanan D, Larsen A, Gauger S, Adafia R, Hammershøi R, Hamborg L, Bruus‐Jensen J, Griem‐Krey N, Gee C, Frølund B, Stratton M, Kuriyan J, Kastrup J, Langkilde A, Wellendorph P, Solbak S",
      "journal": "Protein Science",
      "doi": "10.1002/pro.5152",
      "pmid": null,
      "published_date": "2024 Sep 14"
    },
    "status": "released",
    "submitted_date": "2024-03-18",
    "released_date": "2024-09-18"
  },
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  "experiment": {
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        "resolution": null
      },
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      "city": "DESY; Hamburg",
      "country": "Germany",
      "beamline_name": "EMBL P12",
      "beam_geometry": null,
      "type_of_source": "X-ray synchrotron",
      "point_source": null,
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      "line_collimation_integrationwidth": null,
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    "sample": {
      "molecule": [
        {
          "long_name": "Calcium/calmodulin-dependent protein kinase type II subunit alpha (W403L)",
          "short_name": "CaMKIIα W403L hub",
          "sequence": "GPHMVRKQEIIKVTEQLIEAISNGDFESYTKMCDPGMTAFEPEALGNLVEGLDFHRFYFENLLSRNSKPVHTTILNPHIHLMGDESACIAYIRITQYLDAGGIPRTAQSEETRVWHRRDGKWQIVHFHRSGAPSV",
          "organism": "Homo sapiens",
          "uniprot_code": "Q9UQM7",
          "uniprot_range_first": 345,
          "uniprot_range_last": 475,
          "oligomerization": "dodecamer",
          "molecular_type": "protein",
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          "mw": 15.404,
          "total_mw": 184.848,
          "number_molecules": 12,
          "complex_state": false,
          "deuteration": null,
          "molecule_source": "biological",
          "molecule_description": "W403L mutant of the WT hub domain. The protein construct used for SAXS contains an additional four non-native amino acids at the N-terminus (GPHM)."
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      ],
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        "concentration_unit": null,
        "comment": null,
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        "concentration": null,
        "pka": null,
        "ph": 6.0,
        "deuteration": null
      },
      "purity_method": null,
      "name": "Calcium/calmodulin-dependent protein kinase type II alpha (CaMKIIα) W403L hub domain",
      "ext_coefficient": null,
      "contrast": null,
      "specific_vol": null,
      "dry_vol": null,
      "absorbption": null,
      "deuteration": null,
      "mixture": null
    },
    "contributor": [
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        "affiliation": [
          {
            "short_name": null,
            "address": "Copenhagen, Denmark",
            "full_name": "University of Copenhagen",
            "webpage": "http://www.ku.dk/"
          }
        ],
        "contributor_name": "Annette",
        "contributor_surname": "Langkilde",
        "orcid": ""
      }
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    "concentration_unit": null,
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    "sample_detector_distance": 3.0,
    "concentration_min": null,
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  "description": "Single point mutant for comparison with the WT hub.",
  "experiment_description": "Synchrotron SAXS data from solutions of calcium/calmodulin-dependent protein kinase type II alpha (CaMKIIα) W403L hub domain in 20 mM MES, 150 mM NaCl, 1 mM DTT, pH 6 were collected on the EMBL P12 beam line at PETRA III (DESY; Hamburg, Germany) using a Pilatus 6M detector at a sample-detector distance of 3 m and at a wavelength of λ = 0.124 nm (I(s) vs s, where s = 4πsinθ/λ, and 2θ is the scattering angle). One solute concentration of 6.40 mg/ml was measured at 20°C. 30 successive 0.095 second frames were collected. The data were normalized to the intensity of the transmitted beam and radially averaged; the scattering of the solvent-blank was subtracted.",
  "tags": [],
  "intensity_unit": "1/cm",
  "experimental_mw": 186.0,
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View the complete manifest.json source
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