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- PDB-6v1a: immune receptor complex -

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ID or keywords:

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Basic information

Entry
Database: PDB / ID: 6v1a
Titleimmune receptor complex
Components
  • (HLA class II histocompatibility antigen, ...) x 2
  • Fibrinogen beta 74cit69-81
  • M134 TCR alpha chain
  • M134 TCR beta chain
KeywordsIMMUNE SYSTEM / Immune receptor
Function / homology
Function and homology information


induction of bacterial agglutination / regulation of interleukin-4 production / regulation of interleukin-10 production / myeloid dendritic cell antigen processing and presentation / antigen processing and presentation of endogenous peptide antigen via MHC class II / autolysosome membrane / fibrinogen complex / regulation of T-helper cell differentiation / positive regulation of CD4-positive, CD25-positive, alpha-beta regulatory T cell differentiation / MHC class II receptor activity ...induction of bacterial agglutination / regulation of interleukin-4 production / regulation of interleukin-10 production / myeloid dendritic cell antigen processing and presentation / antigen processing and presentation of endogenous peptide antigen via MHC class II / autolysosome membrane / fibrinogen complex / regulation of T-helper cell differentiation / positive regulation of CD4-positive, CD25-positive, alpha-beta regulatory T cell differentiation / MHC class II receptor activity / positive regulation of CD4-positive, alpha-beta T cell activation / Regulation of TLR by endogenous ligand / platelet alpha granule / antigen processing and presentation of peptide or polysaccharide antigen via MHC class II / positive regulation of T cell mediated immune response to tumor cell / positive regulation of kinase activity / blood coagulation, fibrin clot formation / positive regulation of memory T cell differentiation / cellular response to leptin stimulus / positive regulation of monocyte differentiation / inflammatory response to antigenic stimulus / CD4 receptor binding / positive regulation of heterotypic cell-cell adhesion / MyD88 deficiency (TLR2/4) / intermediate filament / IRAK4 deficiency (TLR2/4) / extracellular matrix structural constituent / MyD88:MAL(TIRAP) cascade initiated on plasma membrane / T-helper 1 type immune response / plasminogen activation / transport vesicle membrane / p130Cas linkage to MAPK signaling for integrins / positive regulation of peptide hormone secretion / Translocation of ZAP-70 to Immunological synapse / positive regulation of vasoconstriction / Phosphorylation of CD3 and TCR zeta chains / polysaccharide binding / GRB2:SOS provides linkage to MAPK signaling for Integrins / negative regulation of type II interferon production / humoral immune response / macrophage differentiation / positive regulation of exocytosis / Generation of second messenger molecules / immunological synapse / Co-inhibition by PD-1 / protein polymerization / cellular response to interleukin-1 / epidermis development / Integrin cell surface interactions / positive regulation of insulin secretion involved in cellular response to glucose stimulus / Common Pathway of Fibrin Clot Formation / detection of bacterium / negative regulation of endothelial cell apoptotic process / negative regulation of extrinsic apoptotic signaling pathway via death domain receptors / T cell receptor binding / fibrinolysis / negative regulation of T cell proliferation / Integrin signaling / positive regulation of substrate adhesion-dependent cell spreading / MHC class II antigen presentation / platelet alpha granule lumen / cell-matrix adhesion / trans-Golgi network membrane / positive regulation of protein secretion / lumenal side of endoplasmic reticulum membrane / protein tetramerization / peptide antigen assembly with MHC class II protein complex / negative regulation of inflammatory response to antigenic stimulus / MHC class II protein complex / clathrin-coated endocytic vesicle membrane / ER to Golgi transport vesicle membrane / Signaling by high-kinase activity BRAF mutants / MAP2K and MAPK activation / response to calcium ion / antigen processing and presentation of exogenous peptide antigen via MHC class II / positive regulation of immune response / positive regulation of T cell activation / peptide antigen binding / structural constituent of cytoskeleton / positive regulation of T cell mediated cytotoxicity / platelet aggregation / cognition / positive regulation of protein phosphorylation / Interferon gamma signaling / Signaling by RAF1 mutants / MHC class II protein complex binding / Signaling by moderate kinase activity BRAF mutants / Paradoxical activation of RAF signaling by kinase inactive BRAF / Signaling downstream of RAS mutants / endocytic vesicle membrane / Signaling by BRAF and RAF1 fusions / late endosome membrane / Downstream TCR signaling / Platelet degranulation / extracellular vesicle / T cell receptor signaling pathway / protein-folding chaperone binding / : / ER-Phagosome pathway / protein-containing complex assembly
Similarity search - Function
Fibrinogen, alpha/beta/gamma chain, coiled coil domain / Fibrinogen alpha/beta chain family / Fibrinogen alpha/beta chain family / Fibrinogen alpha chain / Fibrinogen, conserved site / Fibrinogen C-terminal domain signature. / Fibrinogen-related domains (FReDs) / Fibrinogen beta and gamma chains, C-terminal globular domain / Fibrinogen, alpha/beta/gamma chain, C-terminal globular, subdomain 1 / Fibrinogen, alpha/beta/gamma chain, C-terminal globular domain ...Fibrinogen, alpha/beta/gamma chain, coiled coil domain / Fibrinogen alpha/beta chain family / Fibrinogen alpha/beta chain family / Fibrinogen alpha chain / Fibrinogen, conserved site / Fibrinogen C-terminal domain signature. / Fibrinogen-related domains (FReDs) / Fibrinogen beta and gamma chains, C-terminal globular domain / Fibrinogen, alpha/beta/gamma chain, C-terminal globular, subdomain 1 / Fibrinogen, alpha/beta/gamma chain, C-terminal globular domain / Fibrinogen-like, C-terminal / Fibrinogen C-terminal domain profile. / MHC class II, beta chain, N-terminal / Class II histocompatibility antigen, beta domain / Class II histocompatibility antigen, beta domain / MHC class II, alpha chain, N-terminal / Class II histocompatibility antigen, alpha domain / Class II histocompatibility antigen, alpha domain / MHC class II, alpha/beta chain, N-terminal / MHC classes I/II-like antigen recognition protein / : / Immunoglobulin/major histocompatibility complex, conserved site / Immunoglobulins and major histocompatibility complex proteins signature. / Immunoglobulin C-Type / Immunoglobulin C1-set / Immunoglobulin C1-set domain / Ig-like domain profile. / Immunoglobulin-like domain / Immunoglobulin-like domain superfamily / Immunoglobulin-like fold
Similarity search - Domain/homology
HLA class II histocompatibility antigen, DR alpha chain / HLA class II histocompatibility antigen, DRB1 beta chain / Fibrinogen beta chain / HLA class II histocompatibility antigen, DRB1 beta chain
Similarity search - Component
Biological speciesHomo sapiens (human)
Mus musculus (house mouse)
MethodX-RAY DIFFRACTION / SYNCHROTRON / MOLECULAR REPLACEMENT / Resolution: 2.29 Å
AuthorsLim, J.J. / Rossjohn, J.
Funding support Australia, 1items
OrganizationGrant numberCountry
Australian Research Council (ARC)CE140100011 Australia
CitationJournal: Sci Immunol / Year: 2021
Title: The shared susceptibility epitope of HLA-DR4 binds citrullinated self-antigens and the TCR.
Authors: Lim, J.J. / Jones, C.M. / Loh, T.J. / Ting, Y.T. / Zareie, P. / Loh, K.L. / Felix, N.J. / Suri, A. / McKinnon, M. / Stevenaert, F. / Sharma, R.K. / Klareskog, L. / Malmstrom, V. / Baker, D.G. ...Authors: Lim, J.J. / Jones, C.M. / Loh, T.J. / Ting, Y.T. / Zareie, P. / Loh, K.L. / Felix, N.J. / Suri, A. / McKinnon, M. / Stevenaert, F. / Sharma, R.K. / Klareskog, L. / Malmstrom, V. / Baker, D.G. / Purcell, A.W. / Reid, H.H. / La Gruta, N.L. / Rossjohn, J.
History
DepositionNov 20, 2019Deposition site: RCSB / Processing site: RCSB
Revision 1.0Nov 25, 2020Provider: repository / Type: Initial release
Revision 1.1Jun 9, 2021Group: Database references / Category: citation / citation_author
Item: _citation.country / _citation.journal_abbrev ..._citation.country / _citation.journal_abbrev / _citation.journal_id_CSD / _citation.journal_id_ISSN / _citation.journal_volume / _citation.pdbx_database_id_DOI / _citation.pdbx_database_id_PubMed / _citation.title / _citation.year
Revision 1.2Oct 11, 2023Group: Data collection / Database references / Refinement description
Category: chem_comp_atom / chem_comp_bond ...chem_comp_atom / chem_comp_bond / database_2 / pdbx_initial_refinement_model
Item: _database_2.pdbx_DOI / _database_2.pdbx_database_accession
Revision 2.0Nov 15, 2023Group: Atomic model / Data collection / Derived calculations
Category: atom_site / atom_site_anisotrop ...atom_site / atom_site_anisotrop / chem_comp_atom / chem_comp_bond / pdbx_validate_rmsd_angle / struct_conn
Item: _atom_site.auth_atom_id / _atom_site.label_atom_id ..._atom_site.auth_atom_id / _atom_site.label_atom_id / _atom_site_anisotrop.pdbx_auth_atom_id / _atom_site_anisotrop.pdbx_label_atom_id / _chem_comp_atom.atom_id / _chem_comp_bond.atom_id_1 / _chem_comp_bond.atom_id_2 / _struct_conn.ptnr1_label_atom_id / _struct_conn.ptnr2_label_atom_id
Revision 2.1Oct 23, 2024Group: Structure summary / Category: pdbx_entry_details / pdbx_modification_feature / Item: _pdbx_entry_details.has_protein_modification

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Structure visualization

Structure viewerMolecule:
MolmilJmol/JSmol

Downloads & links

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Assembly

Deposited unit
A: HLA class II histocompatibility antigen, DR alpha chain
B: HLA class II histocompatibility antigen, DRB1-4 beta chain
C: Fibrinogen beta 74cit69-81
D: M134 TCR alpha chain
E: M134 TCR beta chain
hetero molecules


Theoretical massNumber of molelcules
Total (without water)99,30229
Polymers96,7745
Non-polymers2,52824
Water5,206289
1


  • Idetical with deposited unit
  • defined by author
  • Evidence: surface plasmon resonance
TypeNameSymmetry operationNumber
identity operation1_555x,y,z1
Unit cell
Length a, b, c (Å)149.344, 56.990, 131.184
Angle α, β, γ (deg.)90.000, 90.870, 90.000
Int Tables number5
Space group name H-MC121
Space group name HallC2y
Symmetry operation#1: x,y,z
#2: -x,y,-z
#3: x+1/2,y+1/2,z
#4: -x+1/2,y+1/2,-z

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Components

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HLA class II histocompatibility antigen, ... , 2 types, 2 molecules AB

#1: Protein HLA class II histocompatibility antigen, DR alpha chain / MHC class II antigen DRA


Mass: 21919.594 Da / Num. of mol.: 1
Source method: isolated from a genetically manipulated source
Source: (gene. exp.) Homo sapiens (human) / Gene: HLA-DRA, HLA-DRA1 / Cell line (production host): HEK 293S / Production host: Homo sapiens (human) / References: UniProt: P01903
#2: Protein HLA class II histocompatibility antigen, DRB1-4 beta chain / MHC class II antigen DRB1*4 / DR4


Mass: 23080.488 Da / Num. of mol.: 1
Source method: isolated from a genetically manipulated source
Source: (gene. exp.) Homo sapiens (human) / Gene: HLA-DRB1 / Production host: Homo sapiens (human) / References: UniProt: P13760, UniProt: P01911*PLUS

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Protein , 2 types, 2 molecules DE

#4: Protein M134 TCR alpha chain


Mass: 22871.131 Da / Num. of mol.: 1
Source method: isolated from a genetically manipulated source
Source: (gene. exp.) Mus musculus (house mouse) / Production host: Escherichia coli BL21(DE3) (bacteria)
#5: Protein M134 TCR beta chain


Mass: 27609.865 Da / Num. of mol.: 1
Source method: isolated from a genetically manipulated source
Source: (gene. exp.) Mus musculus (house mouse) / Production host: Escherichia coli BL21(DE3) (bacteria)

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Protein/peptide / Sugars , 2 types, 4 molecules C

#3: Protein/peptide Fibrinogen beta 74cit69-81


Mass: 1292.445 Da / Num. of mol.: 1 / Source method: obtained synthetically / Source: (synth.) Homo sapiens (human) / References: UniProt: P02675*PLUS
#6: Sugar ChemComp-NAG / 2-acetamido-2-deoxy-beta-D-glucopyranose / N-acetyl-beta-D-glucosamine / 2-acetamido-2-deoxy-beta-D-glucose / 2-acetamido-2-deoxy-D-glucose / 2-acetamido-2-deoxy-glucose / N-ACETYL-D-GLUCOSAMINE


Type: D-saccharide, beta linking / Mass: 221.208 Da / Num. of mol.: 3 / Source method: isolated from a natural source / Formula: C8H15NO6
IdentifierTypeProgram
DGlcpNAcbCONDENSED IUPAC CARBOHYDRATE SYMBOLGMML 1.0
N-acetyl-b-D-glucopyranosamineCOMMON NAMEGMML 1.0
b-D-GlcpNAcIUPAC CARBOHYDRATE SYMBOLPDB-CARE 1.0
GlcNAcSNFG CARBOHYDRATE SYMBOLGMML 1.0

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Non-polymers , 3 types, 310 molecules

#7: Chemical
ChemComp-GOL / GLYCEROL / GLYCERIN / PROPANE-1,2,3-TRIOL


Mass: 92.094 Da / Num. of mol.: 20 / Source method: obtained synthetically / Formula: C3H8O3
#8: Chemical ChemComp-NA / SODIUM ION


Mass: 22.990 Da / Num. of mol.: 1 / Source method: isolated from a natural source / Formula: Na
#9: Water ChemComp-HOH / water


Mass: 18.015 Da / Num. of mol.: 289 / Source method: isolated from a natural source / Formula: H2O

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Details

Has ligand of interestY
Has protein modificationY

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Experimental details

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Experiment

ExperimentMethod: X-RAY DIFFRACTION / Number of used crystals: 1

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Sample preparation

CrystalDensity Matthews: 2.85 Å3/Da / Density % sol: 56.89 %
Crystal growTemperature: 293 K / Method: vapor diffusion, hanging drop / Details: 0.2 M trisodium citrate, 20% PEG 3350

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Data collection

DiffractionMean temperature: 100 K / Serial crystal experiment: N
Diffraction sourceSource: SYNCHROTRON / Site: Australian Synchrotron / Beamline: MX2 / Wavelength: 0.9537 Å
DetectorType: DECTRIS EIGER X 16M / Detector: PIXEL / Date: Aug 22, 2018
RadiationProtocol: SINGLE WAVELENGTH / Monochromatic (M) / Laue (L): M / Scattering type: x-ray
Radiation wavelengthWavelength: 0.9537 Å / Relative weight: 1
ReflectionResolution: 2.29→49.24 Å / Num. obs: 49925 / % possible obs: 99.1 % / Redundancy: 6.9 % / Biso Wilson estimate: 40.9864860328 Å2 / CC1/2: 0.997 / Rmerge(I) obs: 0.104 / Net I/σ(I): 10.7
Reflection shellResolution: 2.29→2.36 Å / Num. unique obs: 4179 / CC1/2: 0.812 / % possible all: 91.1

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Processing

Software
NameVersionClassification
PHENIX1.10.1_2155refinement
XDSdata reduction
Aimlessdata scaling
PHASERphasing
RefinementMethod to determine structure: MOLECULAR REPLACEMENT
Starting model: 6BIL

6bil


Resolution: 2.29→43.72 Å / SU ML: 0.253021454426 / Cross valid method: FREE R-VALUE / σ(F): 1.34 / Phase error: 23.5391670115
RfactorNum. reflection% reflection
Rfree0.2137 2456 4.92529830542 %
Rwork0.1869 --
obs0.1882 49865 99.0328090245 %
Solvent computationShrinkage radii: 0.9 Å / VDW probe radii: 1.11 Å
Displacement parametersBiso mean: 53.6986682417 Å2
Refinement stepCycle: LAST / Resolution: 2.29→43.72 Å
ProteinNucleic acidLigandSolventTotal
Num. atoms6444 0 163 289 6896
Refine LS restraints
Refine-IDTypeDev idealNumber
X-RAY DIFFRACTIONf_bond_d0.00468249676116772
X-RAY DIFFRACTIONf_angle_d0.6387862115459195
X-RAY DIFFRACTIONf_chiral_restr0.0459969606028999
X-RAY DIFFRACTIONf_plane_restr0.005999336942671180
X-RAY DIFFRACTIONf_dihedral_angle_d21.44827548952427
LS refinement shell
Resolution (Å)Rfactor RfreeNum. reflection RfreeRfactor RworkNum. reflection RworkRefine-ID% reflection obs (%)
2.29-2.33040.3151110.28672200X-RAY DIFFRACTION84.652014652
2.3304-2.3780.2788988288281480.2558789730392651X-RAY DIFFRACTION99.7149982187
2.378-2.42970.2735708821561160.248120785172628X-RAY DIFFRACTION99.9271667881
2.4297-2.48620.2783704454691240.2415023706092666X-RAY DIFFRACTION99.9641705482
2.4862-2.54830.2674223288161550.2380443337072583X-RAY DIFFRACTION99.8905508938
2.5483-2.61720.2468342783311380.2275014934452657X-RAY DIFFRACTION99.8570918185
2.6172-2.69420.2622643035691300.2265504556822649X-RAY DIFFRACTION99.6771879484
2.6942-2.78120.2821521794761360.2167680272532646X-RAY DIFFRACTION99.9281609195
2.7812-2.88060.2455094190621250.2054974109412650X-RAY DIFFRACTION99.8201438849
2.8806-2.99590.2032469230391290.2011407683052671X-RAY DIFFRACTION99.8573466476
2.9959-3.13220.2354589132161250.1944876839972666X-RAY DIFFRACTION99.9641833811
3.1322-3.29730.215738230841500.1963353829792620X-RAY DIFFRACTION99.8198198198
3.2973-3.50380.2129426880631490.181041255032637X-RAY DIFFRACTION99.7851002865
3.5038-3.77420.2066245969391360.1690883422862705X-RAY DIFFRACTION99.9296517763
3.7742-4.15370.2077598352531040.1642561998492675X-RAY DIFFRACTION99.856270212
4.1537-4.75410.1626384687041490.1419292377142682X-RAY DIFFRACTION99.9294034592
4.7541-5.98730.1886566861780.1629717931572652X-RAY DIFFRACTION99.9293785311
5.9873-43.720.2013204776651530.1915619161582771X-RAY DIFFRACTION99.795221843
Refinement TLS params.

Method: refined / Refine-ID: X-RAY DIFFRACTION

IDL11 (°2)L12 (°2)L13 (°2)L22 (°2)L23 (°2)L33 (°2)S11 (Å °)S12 (Å °)S13 (Å °)S21 (Å °)S22 (Å °)S23 (Å °)S31 (Å °)S32 (Å °)S33 (Å °)T11 (Å2)T12 (Å2)T13 (Å2)T22 (Å2)T23 (Å2)T33 (Å2)Origin x (Å)Origin y (Å)Origin z (Å)
14.080742920321.10128339228-0.5526815208222.20960911334-0.07167784449012.27142342418-0.1516140250920.251389072249-0.0080482213847-0.3233289541330.1159431466630.2948330018470.576138146908-0.08414703600470.0308077658780.42453833038-0.107192837159-0.02734190539790.55979512562-0.1098759938090.364248972047-26.1317300428-13.166395889319.295624826
23.0323875659-0.1381248747060.2885831809682.282353404840.4211782529523.78734217501-0.1589520497810.389369578872-0.633367452520.004113186706540.157196395969-0.1800674117450.6296563003460.128873618416-0.01653394060450.416891698026-0.04064632443230.03495505413160.464880074749-0.1171390442930.460015682266-14.9714895358-17.771541259122.3964656918
30.8788341560860.115288030776-0.251043985291.27452039840.7688462187082.05869520733-0.02864221450750.527100653242-0.360869322312-0.211098182136-0.005294744455490.1876997862470.451544102621-0.385251872140.09110481193550.526896093476-0.144596332455-0.08034254150710.657107075997-0.1409535442550.506316819448-30.9654869674-20.780005464815.6323532799
40.956636736586-0.239544830198-0.4051174986891.9524391381.191510395161.67298633607-0.1099996371080.25986614947-0.413925814202-0.2630350642790.1621198576660.02933830846320.535668149095-0.1832866683810.04038363553280.699598500016-0.174310291637-0.0441003225040.793045948686-0.194272594780.614554929645-27.4856850417-28.606966284112.5452630798
54.61589547989-3.1058610891-1.782582831585.102939629642.285471446813.657677856940.1630359618060.421714206776-0.512869791508-0.269618524314-0.0508338975674-0.2158406095060.527976653035-0.05965878729820.02216013572610.648297609403-0.1336138914670.02082342760870.647956474559-0.2425878990370.625017132109-21.6337004382-28.55594728529.67404954426
61.57337414237-1.35580640977-0.6853122428262.172304614471.55461467011.92484903726-0.02435911399920.277148190534-0.472107534445-0.19448000205-0.1977826451160.2098514038180.910937520641-0.2336458741640.1114424063241.03134489527-0.2576703678380.00131434447370.840197040536-0.3007926926680.785117304943-28.3592744978-36.45999138243.86823685982
72.992447695320.872331562451-0.6043860644441.658665627210.2601209499992.00577100223-0.1675982302210.219370221234-0.334103963563-0.379842311020.1043736051720.1442876068370.565552873431-0.4184009020990.03423749904880.425390724909-0.131374952457-0.04250396045910.628262730289-0.06312324197260.429161607872-33.4851787569-12.7863503418.9332949116
82.424856875860.5383747524490.4210069590152.377467828690.7092902380612.16909510341-0.0003440502363710.428796980861-0.0197202240622-0.391861176004-0.04686717746180.0396383538387-0.174792163228-0.3718314036660.007104563115210.375103739008-0.0482143759953-0.07073081096130.526110319192-0.0001884924740790.286368350964-26.1147651142-0.36061003799816.0335969952
90.220200326557-0.488634903933-0.6255249327841.005513864921.433746265792.09659638415-0.01073263725610.135113033747-0.247428449044-0.749507539124-0.3209700829270.2339689620760.258835119959-0.8062907089220.3453298369830.444725375272-0.082772190254-0.1285961798090.781541840597-0.04458731685160.385652704367-37.0425814896-4.1591083647117.8663312987
101.322003240670.779495058781-0.1085198984041.951956277090.06189905244482.794961369160.08841730839530.3830506224250.199538387782-0.1891388731930.001445032732060.583653739885-0.161010261106-0.9002517303160.0996327253790.329399032360.023743592813-0.05799908531550.6722700348530.02302751290440.469037016349-38.49740058013.3791574299223.2766426607
112.88126517739-1.14053813022-2.485419088521.016744777520.2961229986213.57331847355-0.3619078126080.0227302146950.0703863459961-0.05556171119940.303919391856-0.007236827894-0.0798256948595-0.0165265378512-0.06857738145660.340070242187-0.043122685273-0.04307531606320.44758375440.0282217352550.366204516651-25.86266513246.2803034565827.9051639923
120.5831784677470.0589979110085-0.03591599859911.580617393721.11703461312.30165400974-0.02829698817470.205079891512-0.271882363234-0.4580906064460.16652051563-0.200087378912-0.08280482919480.513522848478-0.1944009524530.396356044432-0.06108129534030.05471432823170.624392539339-0.08622984993030.423099446576-10.3772329832-7.453828094413.9949226795
130.857790640823-0.279089870807-0.1185166975851.293837832071.347114023783.706386037740.1757662935111.46477237306-0.489049393887-0.497513520623-0.1480626142080.0935175922453-0.0388750009945-0.327916435947-0.09352536823280.633238982646-0.02012984345860.02841081127571.29213780665-0.337284750330.528348910758-11.1975449372-20.1007497533-7.75884384902
140.9487977992980.134390115477-1.09656713830.00527173386322-0.1525199420871.278626987530.1188069314510.8934901538690.428184011924-0.513486574731-0.153422484542-0.0610015328653-0.08119266314940.0300166961995-0.2174114009741.036738349210.0610531382859-0.09446967049311.54719231362-0.1806225871670.678359119-13.4150151637-15.9296435685-19.6069647305
151.20199835116-0.061801932122-0.79125523780.922207075947-0.07329805308973.561179956460.4002317184070.998057319581-0.513577261752-0.33069466797-0.1292305833150.1943588812840.268690859216-0.205534029719-0.01955849293790.619916919525-0.08358058932410.03606679091621.0445693993-0.2493424026980.500647322508-16.555031812-19.8416180644-0.266733669882
160.299550001369-0.495346249574-0.475771489930.988245044331.636467749095.67544790646-0.2569807302470.987256764031-0.649893654133-0.6261692330340.3595225248610.137939022842-0.13358575412-0.125513075948-0.1122332665190.732058391617-0.0967404768122-0.0248504143221.65650320511-0.3194472305190.557052403617-8.27636101839-18.1930120975-14.6580858351
170.114555606434-0.26734494166-0.2348513314160.6145712983850.8685638297371.315323642690.07242400736561.20881515841-0.678569862941-0.4748784694750.1783132618240.259035197857-0.1068555357370.116018847987-0.1352153565520.6617555566430.002741344181130.05407769941981.24548395903-0.227690665490.672815468881-2.90966652437-16.0059198047-8.1437642188
180.1891007817340.1943320397110.5735185592631.19781772310.3351028293351.484187305140.06472122144950.2573204583080.0698900241177-0.19971219664-0.0265406774630.15494028153-0.0884247581735-0.304628644159-0.03908900720960.26627174573-0.05229479037890.02711781111170.395923506809-0.0639486092340.338121851998-25.8025799142-4.9176446497128.3970320569
192.010971638550.7640421973360.4851682615851.636391082710.3283399124592.72432699541-0.07621149180410.298216105736-0.3227477050760.01879408685050.195176641404-0.2984898467450.1568612946740.217992897538-0.1688518590920.207354793147-0.02064429104290.02044268155310.313479992988-0.009659980797020.523560993803-5.6543137545610.0573996345.9000404898
200.7575134496010.5801399180590.5647641224221.880188158961.37870585531.93976584422-0.07969938129970.1942184067040.0599313897217-0.1070961227710.0958576973265-0.0619162426092-0.1724569073580.139847798703-0.09115849599690.251719853148-0.04467149464520.02164396896520.3475437439630.03302897275680.411336995544-12.395072590513.381254181944.847508193
212.499566336670.1234371451920.4089186915022.4116389838-0.2537057794932.179772158330.0105605691105-0.20717207580.1535317069870.1496691377410.0858246031673-0.0557837800302-0.0449986762906-0.00964587319076-0.1016516960810.2381397159880.01583196373410.001445735361240.265709679799-0.01532976699060.453077287543-12.178065516325.872501868775.9873888532
220.752572080338-0.16575399017-0.2945730518061.228042894820.408442163144.227247834330.05333007403940.0260704987690.01735699484890.0954155557179-0.00368110011323-0.00123449397960.103706890709-0.07808327109110.02204310694970.219415403796-0.0380359126292-0.00182590249570.3005697175580.007572185179110.430279744211-27.3518292202-2.0280201430952.9926781048
230.3490964304940.325740112789-0.4396998302540.852879204718-0.08182295051092.911612082970.04326297380290.115316854074-0.194671087555-0.0114810614422-0.0061836665550.1222857888490.383484022163-0.07236200542490.002625031930020.271107062881-0.0206480885985-0.02611652403670.3472439827640.000246987892160.442094026145-26.5892424154-6.1900891332548.659181936
241.77606161027-0.382964215056-0.001723994025122.525459539353.187174442444.42369741060.0531809497627-0.191621023418-0.1675341395520.46846895290.159374657817-0.1282263913980.5299797082150.20749578077-0.004692995572040.277175027959-0.04332956022690.004947586884470.2414448390020.06377505229680.355133764256-25.1886689692-1.2771077296172.6511028076
251.32885373940.511880346711-0.1011014761912.388670215910.1481753298691.388841102450.03018373937690.01041069999220.0810107173953-0.0536604459095-0.00116734469881-0.100320902106-0.0373537597434-0.0827449999818-0.006914311222790.2068437069490.02432316945490.0157503864780.2484918014140.0009440717787450.392992181467-24.76349033622.013172117773.4300498138
261.59820513283-0.952578733145-0.4013005358154.7029755379-0.1871598741122.238403767330.00661437326634-0.125387575315-0.1924769723930.438304727464-0.1012497271450.4656663368650.386496687613-0.3644680467050.08405457977120.286515065187-0.06640275220720.08049071062690.3720373192450.007550672145570.402961924957-33.8451075918.6896081851977.992892198
Refinement TLS group
IDRefine-IDRefine TLS-IDSelection details
1X-RAY DIFFRACTION1chain 'A' and (resid 2 through 26 )
2X-RAY DIFFRACTION2chain 'A' and (resid 27 through 55 )
3X-RAY DIFFRACTION3chain 'A' and (resid 56 through 112 )
4X-RAY DIFFRACTION4chain 'A' and (resid 113 through 144 )
5X-RAY DIFFRACTION5chain 'A' and (resid 145 through 154 )
6X-RAY DIFFRACTION6chain 'A' and (resid 155 through 181 )
7X-RAY DIFFRACTION7chain 'B' and (resid 2 through 18 )
8X-RAY DIFFRACTION8chain 'B' and (resid 19 through 32 )
9X-RAY DIFFRACTION9chain 'B' and (resid 33 through 41 )
10X-RAY DIFFRACTION10chain 'B' and (resid 42 through 63 )
11X-RAY DIFFRACTION11chain 'B' and (resid 64 through 77 )
12X-RAY DIFFRACTION12chain 'B' and (resid 78 through 97 )
13X-RAY DIFFRACTION13chain 'B' and (resid 98 through 132 )
14X-RAY DIFFRACTION14chain 'B' and (resid 133 through 144 )
15X-RAY DIFFRACTION15chain 'B' and (resid 145 through 161 )
16X-RAY DIFFRACTION16chain 'B' and (resid 162 through 177 )
17X-RAY DIFFRACTION17chain 'B' and (resid 178 through 188 )
18X-RAY DIFFRACTION18chain 'C' and (resid 69 through 81 )
19X-RAY DIFFRACTION19chain 'D' and (resid 2 through 33 )
20X-RAY DIFFRACTION20chain 'D' and (resid 34 through 134 )
21X-RAY DIFFRACTION21chain 'D' and (resid 135 through 218 )
22X-RAY DIFFRACTION22chain 'E' and (resid 3 through 57 )
23X-RAY DIFFRACTION23chain 'E' and (resid 58 through 121 )
24X-RAY DIFFRACTION24chain 'E' and (resid 122 through 136 )
25X-RAY DIFFRACTION25chain 'E' and (resid 137 through 227 )
26X-RAY DIFFRACTION26chain 'E' and (resid 228 through 257 )

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