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Yorodumi- EMDB-71402: CryoEM structure of the open integrin alphaEbeta7 bound to fab LF61 -
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Open data
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Basic information
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| Title | CryoEM structure of the open integrin alphaEbeta7 bound to fab LF61 | ||||||||||||
Map data | Sharpened, locally refined map of the open integrin alphaEbeta7 bound to fab LF61 | ||||||||||||
Sample |
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Keywords | aEb7 / gut adhesion / tissue residence / membrane receptor / CELL ADHESION | ||||||||||||
| Function / homology | Function and homology informationimmune response in gut-associated lymphoid tissue / cell-matrix adhesion involved in ameboidal cell migration / integrin alpha4-beta7 complex / leukocyte tethering or rolling / integrin complex / heterotypic cell-cell adhesion / leukocyte migration / cell adhesion mediated by integrin / receptor clustering / Integrin cell surface interactions ...immune response in gut-associated lymphoid tissue / cell-matrix adhesion involved in ameboidal cell migration / integrin alpha4-beta7 complex / leukocyte tethering or rolling / integrin complex / heterotypic cell-cell adhesion / leukocyte migration / cell adhesion mediated by integrin / receptor clustering / Integrin cell surface interactions / T cell migration / cell adhesion molecule binding / substrate adhesion-dependent cell spreading / cell-matrix adhesion / integrin-mediated signaling pathway / cell-cell adhesion / integrin binding / Immunoregulatory interactions between a Lymphoid and a non-Lymphoid cell / virus receptor activity / receptor complex / cell adhesion / external side of plasma membrane / focal adhesion / cell surface / extracellular exosome / metal ion binding / membrane / plasma membrane Similarity search - Function | ||||||||||||
| Biological species | ![]() Homo sapiens (human) | ||||||||||||
| Method | single particle reconstruction / cryo EM / Resolution: 2.93 Å | ||||||||||||
Authors | Hollis JA / Campbell MG | ||||||||||||
| Funding support | United States, 3 items
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Citation | Journal: Sci Adv / Year: 2025Title: Molecular exaptation by the integrin αI domain. Authors: Jeremy A Hollis / Matthew C Chan / Harmit S Malik / Melody G Campbell / ![]() Abstract: Integrins bind ligands between their alpha (α) and beta (β) subunits and transmit signals through conformational changes. Early in chordate evolution, some α subunits acquired an "inserted" (I) ...Integrins bind ligands between their alpha (α) and beta (β) subunits and transmit signals through conformational changes. Early in chordate evolution, some α subunits acquired an "inserted" (I) domain that expanded integrin's ligand-binding repertoire but obstructed the ancestral ligand pocket, seemingly blocking conventional integrin activation. Here, we compare cryo-electron microscopy structures of apo and ligand-bound states of the I domain-containing αEβ integrin and the I domain-lacking αβ integrin to illuminate how the I domain intrinsically mimics an extrinsic ligand to preserve integrin function. We trace the I domain's evolutionary origin to an ancestral collagen-collagen interaction domain, identifying an ancient molecular exaptation that facilitated integrin activation immediately upon I domain insertion. Our analyses reveal the evolutionary and biochemical basis of expanded cellular communication in vertebrates. | ||||||||||||
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Structure visualization
| Supplemental images |
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Downloads & links
-EMDB archive
| Map data | emd_71402.map.gz | 116.7 MB | EMDB map data format | |
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| Header (meta data) | emd-71402-v30.xml emd-71402.xml | 29.3 KB 29.3 KB | Display Display | EMDB header |
| FSC (resolution estimation) | emd_71402_fsc.xml | 10.8 KB | Display | FSC data file |
| Images | emd_71402.png | 50.3 KB | ||
| Masks | emd_71402_msk_1.map | 134.6 MB | Mask map | |
| Filedesc metadata | emd-71402.cif.gz | 7.6 KB | ||
| Others | emd_71402_additional_1.map.gz emd_71402_additional_2.map.gz emd_71402_additional_3.map.gz emd_71402_additional_4.map.gz emd_71402_half_map_1.map.gz emd_71402_half_map_2.map.gz | 124.9 MB 124.9 MB 67.9 MB 67.8 MB 124.8 MB 124.8 MB | ||
| Archive directory | http://ftp.pdbj.org/pub/emdb/structures/EMD-71402 ftp://ftp.pdbj.org/pub/emdb/structures/EMD-71402 | HTTPS FTP |
-Validation report
| Summary document | emd_71402_validation.pdf.gz | 730.5 KB | Display | EMDB validaton report |
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| Full document | emd_71402_full_validation.pdf.gz | 730.1 KB | Display | |
| Data in XML | emd_71402_validation.xml.gz | 19.2 KB | Display | |
| Data in CIF | emd_71402_validation.cif.gz | 25.2 KB | Display | |
| Arichive directory | https://ftp.pdbj.org/pub/emdb/validation_reports/EMD-71402 ftp://ftp.pdbj.org/pub/emdb/validation_reports/EMD-71402 | HTTPS FTP |
-Related structure data
| Related structure data | ![]() 9p98MC ![]() 9p95C ![]() 9p96C ![]() 9p97C ![]() 9p99C M: atomic model generated by this map C: citing same article ( |
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| Similar structure data | Similarity search - Function & homology F&H Search |
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Links
| EMDB pages | EMDB (EBI/PDBe) / EMDataResource |
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| Related items in Molecule of the Month |
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Map
| File | Download / File: emd_71402.map.gz / Format: CCP4 / Size: 134.6 MB / Type: IMAGE STORED AS FLOATING POINT NUMBER (4 BYTES) | ||||||||||||||||||||||||||||||||||||
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| Annotation | Sharpened, locally refined map of the open integrin alphaEbeta7 bound to fab LF61 | ||||||||||||||||||||||||||||||||||||
| Projections & slices | Image control
Images are generated by Spider. | ||||||||||||||||||||||||||||||||||||
| Voxel size | X=Y=Z: 1.122 Å | ||||||||||||||||||||||||||||||||||||
| Density |
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| Symmetry | Space group: 1 | ||||||||||||||||||||||||||||||||||||
| Details | EMDB XML:
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-Supplemental data
-Mask #1
| File | emd_71402_msk_1.map | ||||||||||||
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| Projections & Slices |
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| Density Histograms |
-Additional map: Non-uniform refined half map A of the open...
| File | emd_71402_additional_1.map | ||||||||||||
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| Annotation | Non-uniform refined half map A of the open integrin alphaEbeta7 bound to fab LF61 | ||||||||||||
| Projections & Slices |
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| Density Histograms |
-Additional map: Non-uniform refined half map B of the open...
| File | emd_71402_additional_2.map | ||||||||||||
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| Annotation | Non-uniform refined half map B of the open integrin alphaEbeta7 bound to fab LF61 | ||||||||||||
| Projections & Slices |
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| Density Histograms |
-Additional map: Unsharpened, locally refined map of the open integrin...
| File | emd_71402_additional_3.map | ||||||||||||
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| Annotation | Unsharpened, locally refined map of the open integrin alphaEbeta7 bound to fab LF61 | ||||||||||||
| Projections & Slices |
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| Density Histograms |
-Additional map: Unsharpened, non-uniform refined map of the open integrin...
| File | emd_71402_additional_4.map | ||||||||||||
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| Annotation | Unsharpened, non-uniform refined map of the open integrin alphaEbeta7 bound to fab LF61 | ||||||||||||
| Projections & Slices |
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| Density Histograms |
-Half map: Locally refined half map A of the open...
| File | emd_71402_half_map_1.map | ||||||||||||
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| Annotation | Locally refined half map A of the open integrin alphaEbeta7 bound to fab LF61 | ||||||||||||
| Projections & Slices |
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| Density Histograms |
-Half map: Locally refined half map B of the open...
| File | emd_71402_half_map_2.map | ||||||||||||
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| Annotation | Locally refined half map B of the open integrin alphaEbeta7 bound to fab LF61 | ||||||||||||
| Projections & Slices |
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| Density Histograms |
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Sample components
-Entire : Protein complex of open integrin alphaEbeta7 with fab LF61
| Entire | Name: Protein complex of open integrin alphaEbeta7 with fab LF61 |
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| Components |
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-Supramolecule #1: Protein complex of open integrin alphaEbeta7 with fab LF61
| Supramolecule | Name: Protein complex of open integrin alphaEbeta7 with fab LF61 type: complex / ID: 1 / Parent: 0 / Macromolecule list: #1-#4 |
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| Source (natural) | Organism: ![]() |
-Macromolecule #1: Integrin alpha-E
| Macromolecule | Name: Integrin alpha-E / type: protein_or_peptide / ID: 1 / Details: Ectodomain / Number of copies: 1 / Enantiomer: LEVO |
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| Source (natural) | Organism: Homo sapiens (human) |
| Molecular weight | Theoretical: 129.950203 KDa |
| Recombinant expression | Organism: ![]() |
| Sequence | String: MWLFHTLLCI ASLALLAAFN VDVARPWLTP KGGAPFVLSS LLHQDPSTNQ TWLLVTSPRT KRTPGPLHRC SLVQDEILCH PVEHVPIPK GRHRGVTVVR SHHGVLICIQ VLVRRPHSLS SELTGTCSLL GPDLRPQAQA NFFDLENLLD PDARVDTGDC Y SNKEGGGE ...String: MWLFHTLLCI ASLALLAAFN VDVARPWLTP KGGAPFVLSS LLHQDPSTNQ TWLLVTSPRT KRTPGPLHRC SLVQDEILCH PVEHVPIPK GRHRGVTVVR SHHGVLICIQ VLVRRPHSLS SELTGTCSLL GPDLRPQAQA NFFDLENLLD PDARVDTGDC Y SNKEGGGE DDVNTARQRR ALEKEEEEDK EEEEDEEEEE AGTEIAIILD GSGSIDPPDF QRAKDFISNM MRNFYEKCFE CN FALVQYG GVIQTEFDLR DSQDVMASLA RVQNITQVGS VTKTASAMQH VLDSIFTSSH GSRRKASKVM VVLTDGGIFE DPL NLTTVI NSPKMQGVER FAIGVGEEFK SARTARELNL IASDPDETHA FKVTNYMALD GLLSKLRYNI ISMEGTVGDA LHYQ LAQIG FSAQILDERQ VLLGAVGAFD WSGGALLYDT RSRRGRFLNQ TAAAAADAEA AQYSYLGYAV AVLHKTCSLS YIAGA PRYK HHGAVFELQK EGREASFLPV LEGEQMGSYF GSELCPVDID MDGSTDFLLV AAPFYHVHGE EGRVYVYRLS EQDGSF SLA RILSGHPGFT NARFGFAMAA MGDLSQDKLT DVAIGAPLEG FGADDGASFG SVYIYNGHWD GLSASPSQRI RASTVAP GL QYFGMSMAGG FDISGDGLAD ITVGTLGQAV VFRSRPVVRL KVSMAFTPSA LPIGFNGVVN VRLCFEISSV TTASESGL R EALLNFTLDV DVGKQRRRLQ CSDVRSCLGC LREWSSGSQL CEDLLLMPTE GELCEEDCFS NASVKVSYQL QTPEGQTDH PQPILDRYTE PFAIFQLPYE KACKNKLFCV AELQLATTVS QQELVVGLTK ELTLNINLTN SGEDSYMTSM ALNYPRNLQL KRMQKPPSP NIQCDDPQPV ASVLIMNCRI GHPVLKRSSA HVSVVWQLEE NAFPNRTADI TVTVTNSNER RSLANETHTL Q FRHGFVAV LSKPSIMYVN TGQGLSHHKE FLFHVHGENL FGAEYQLQIC VPTKLRGLQV VAVKKLTRTQ ASTVCTWSQE RA CAYSSVQ HVEEWHSVSC VIASDKENVT VAAEISWDHS EELLKDVTEL QILGEISFNK SLYEGLNAEN HRTKITVVFL KDE KYHGTG GLEVLFQGPG ENAQCEKELQ ALEKENAQLE WELQALEKEL AQWSHPQFEK UniProtKB: Integrin alpha-E |
-Macromolecule #2: Integrin beta-7
| Macromolecule | Name: Integrin beta-7 / type: protein_or_peptide / ID: 2 / Number of copies: 1 / Enantiomer: LEVO |
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| Source (natural) | Organism: Homo sapiens (human) |
| Molecular weight | Theoretical: 84.538789 KDa |
| Recombinant expression | Organism: ![]() |
| Sequence | String: MVALPMVLVL LLVLSRGESE LDAKIPSTGD ATEWRNPHLS MLGSCQPAPS CQKCILSHPS CAWCKQLNFT ASGEAEARRC ARREELLAR GCPLEELEEP RGQQEVLQDQ PLSQGARGEG ATQLAPQRVR VTLRPGEPQQ LQVRFLRAEG YPVDLYYLMD L SYSMKDDL ...String: MVALPMVLVL LLVLSRGESE LDAKIPSTGD ATEWRNPHLS MLGSCQPAPS CQKCILSHPS CAWCKQLNFT ASGEAEARRC ARREELLAR GCPLEELEEP RGQQEVLQDQ PLSQGARGEG ATQLAPQRVR VTLRPGEPQQ LQVRFLRAEG YPVDLYYLMD L SYSMKDDL ERVRQLGHAL LVRLQEVTHS VRIGFGSFVD KTVLPFVSTV PSKLRHPCPT RLERCQSPFS FHHVLSLTGD AQ AFEREVG RQSVSGNLDS PEGGFDAILQ AALCQEQIGW RNVSRLLVFT SDDTFHTAGD GKLGGIFMPS DGHCHLDSNG LYS RSTEFD YPSVGQVAQA LSAANIQPIF AVTSAALPVY QELSKLIPKS AVGELSEDSS NVVQLIMDAY NSLSSTVTLE HSSL PPGVH ISYESQCEGP EKREGKAEDR GQCNHVRINQ TVTFWVSLQA THCLPEPHLL RLRALGFSEE LIVELHTLCD CNCSD TQPQ APHCSDGQGH LQCGVCSCAP GRLGRLCECS VAELSSPDLE SGCRAPNGTG PLCSGKGHCQ CGRCSCSGQS SGHLCE CDD ASCERHEGIL CGGFGRCQCG VCHCHANRTG RACECSGDMD SCISPEGGLC SGHGRCKCNR CQCLDGYYGA LCDQCPG CK TPCERHRDCA ECGAFRTGPL ATNCSTACAH TNVTLALAPI LDDGWCKERT LDNQLFFFLV EDDARGTVVL RVRPQEKG A DHDTSGLEVL FQGPGKNAQC KKKLQALKKK NAQLKWKLQA LKKKLAQGGH HHHHH UniProtKB: Integrin beta-7 |
-Macromolecule #3: Fab LF61 Heavy Chain
| Macromolecule | Name: Fab LF61 Heavy Chain / type: protein_or_peptide / ID: 3 / Number of copies: 1 / Enantiomer: LEVO |
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| Source (natural) | Organism: ![]() |
| Molecular weight | Theoretical: 23.634564 KDa |
| Recombinant expression | Organism: ![]() |
| Sequence | String: MVQLQRAGPT IVKPGSAVKL SCKATGFAYE DYYIFWVRQR EGGNGQKWIG RIHPGSGETK YNDKFKGKAT LTADTEASSA YMRLTSLTS EDTAVWYCGW ERSVGRATFA YWGQGTSVTV SSAKTTPPSV YPLAPGSAAQ TNSMVTLGCL VKGYFPEPVT V TWNSGSLS ...String: MVQLQRAGPT IVKPGSAVKL SCKATGFAYE DYYIFWVRQR EGGNGQKWIG RIHPGSGETK YNDKFKGKAT LTADTEASSA YMRLTSLTS EDTAVWYCGW ERSVGRATFA YWGQGTSVTV SSAKTTPPSV YPLAPGSAAQ TNSMVTLGCL VKGYFPEPVT V TWNSGSLS SGVHTFPAVL QSDLYTLSSS VTVPSSTWPS ETVTCNVAHP ASSTKVDKKI VP |
-Macromolecule #4: Fab LF61 Light Chain
| Macromolecule | Name: Fab LF61 Light Chain / type: protein_or_peptide / ID: 4 / Number of copies: 1 / Enantiomer: LEVO |
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| Source (natural) | Organism: ![]() |
| Molecular weight | Theoretical: 23.439385 KDa |
| Recombinant expression | Organism: ![]() |
| Sequence | String: AAITFNLAPE SLVVTAGSKV TFSCKASQDF LNSATKRNYL TWYQQRDGKP PKLLIYWASA RLSGVPARFT GSGGGGTEFT LTISSVKAA DIGTYYCRQL RSRPLTFGGG TKLTVKQPKS SPSVTLFPPS SEELETNKAT LVCTITDFYP GVVTVDWKVD G TPVTQGME ...String: AAITFNLAPE SLVVTAGSKV TFSCKASQDF LNSATKRNYL TWYQQRDGKP PKLLIYWASA RLSGVPARFT GSGGGGTEFT LTISSVKAA DIGTYYCRQL RSRPLTFGGG TKLTVKQPKS SPSVTLFPPS SEELETNKAT LVCTITDFYP GVVTVDWKVD G TPVTQGME TTQPSKQSNN KYMASSYLTL TARAWERHSS YSCQVTHEGH TVEKSLS |
-Macromolecule #7: 2-acetamido-2-deoxy-beta-D-glucopyranose
| Macromolecule | Name: 2-acetamido-2-deoxy-beta-D-glucopyranose / type: ligand / ID: 7 / Number of copies: 3 / Formula: NAG |
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| Molecular weight | Theoretical: 221.208 Da |
| Chemical component information | ![]() ChemComp-NAG: |
-Macromolecule #8: CALCIUM ION
| Macromolecule | Name: CALCIUM ION / type: ligand / ID: 8 / Number of copies: 6 / Formula: CA |
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| Molecular weight | Theoretical: 40.078 Da |
-Experimental details
-Structure determination
| Method | cryo EM |
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Processing | single particle reconstruction |
| Aggregation state | particle |
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Sample preparation
| Concentration | 0.15 mg/mL |
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| Buffer | pH: 7.4 |
| Vitrification | Cryogen name: ETHANE |
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Electron microscopy
| Microscope | TFS GLACIOS |
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| Image recording | Film or detector model: GATAN K3 (6k x 4k) / Average electron dose: 50.0 e/Å2 |
| Electron beam | Acceleration voltage: 200 kV / Electron source: FIELD EMISSION GUN |
| Electron optics | Illumination mode: FLOOD BEAM / Imaging mode: BRIGHT FIELD / Nominal defocus max: 1.8 µm / Nominal defocus min: 1.2 µm |
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About Yorodumi



Keywords
Homo sapiens (human)
Authors
United States, 3 items
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Processing
FIELD EMISSION GUN
