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- PDB-5u17: Structure of human MR1-DA-6-FP in complex with human MAIT A-F7 TCR -

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ID or keywords:

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Basic information

Entry
Database: PDB / ID: 5u17
TitleStructure of human MR1-DA-6-FP in complex with human MAIT A-F7 TCR
Components
  • (MAIT T-cell receptor ...) x 2
  • Beta-2-microglobulinBeta-2 microglobulin
  • Major histocompatibility complex class I-related gene protein
KeywordsIMMUNE SYSTEM / T-cell receptor complex
Function / homology
Function and homology information


positive regulation of T cell mediated cytotoxicity directed against tumor cell target / antigen processing and presentation of exogenous antigen / MHC class I receptor activity / antigen processing and presentation of peptide antigen via MHC class I / beta-2-microglobulin binding / T cell receptor binding / positive regulation of ferrous iron binding / positive regulation of transferrin receptor binding / early endosome lumen / positive regulation of receptor binding ...positive regulation of T cell mediated cytotoxicity directed against tumor cell target / antigen processing and presentation of exogenous antigen / MHC class I receptor activity / antigen processing and presentation of peptide antigen via MHC class I / beta-2-microglobulin binding / T cell receptor binding / positive regulation of ferrous iron binding / positive regulation of transferrin receptor binding / early endosome lumen / positive regulation of receptor binding / Nef mediated downregulation of MHC class I complex cell surface expression / DAP12 interactions / negative regulation of receptor binding / Endosomal/Vacuolar pathway / Antigen Presentation: Folding, assembly and peptide loading of class I MHC / antigen processing and presentation of exogenous protein antigen via MHC class Ib, TAP-dependent / cellular response to iron(III) ion / negative regulation of forebrain neuron differentiation / ER to Golgi transport vesicle membrane / peptide antigen assembly with MHC class I protein complex / response to molecule of bacterial origin / regulation of erythrocyte differentiation / regulation of iron ion transport / MHC class I peptide loading complex / HFE-transferrin receptor complex / T cell mediated cytotoxicity / cellular response to iron ion / antigen processing and presentation of endogenous peptide antigen via MHC class I / positive regulation of T cell cytokine production / MHC class I protein complex / multicellular organismal-level iron ion homeostasis / positive regulation of T cell mediated cytotoxicity / peptide antigen assembly with MHC class II protein complex / negative regulation of neurogenesis / MHC class II protein complex / positive regulation of receptor-mediated endocytosis / cellular response to nicotine / recycling endosome membrane / phagocytic vesicle membrane / specific granule lumen / peptide antigen binding / positive regulation of cellular senescence / antigen processing and presentation of exogenous peptide antigen via MHC class II / Immunoregulatory interactions between a Lymphoid and a non-Lymphoid cell / Interferon gamma signaling / positive regulation of immune response / negative regulation of epithelial cell proliferation / Modulation by Mtb of host immune system / positive regulation of T cell activation / sensory perception of smell / negative regulation of neuron projection development / tertiary granule lumen / DAP12 signaling / MHC class II protein complex binding / late endosome membrane / T cell differentiation in thymus / positive regulation of protein binding / ER-Phagosome pathway / iron ion transport / protein refolding / early endosome membrane / protein homotetramerization / intracellular iron ion homeostasis / defense response to Gram-negative bacterium / amyloid fibril formation / learning or memory / defense response to Gram-positive bacterium / immune response / Amyloid fiber formation / lysosomal membrane / endoplasmic reticulum lumen / external side of plasma membrane / Golgi membrane / focal adhesion / innate immune response / Neutrophil degranulation / endoplasmic reticulum membrane / SARS-CoV-2 activates/modulates innate and adaptive immune responses / structural molecule activity / Golgi apparatus / endoplasmic reticulum / protein homodimerization activity / extracellular space / extracellular exosome / extracellular region / membrane / identical protein binding / plasma membrane / cytosol
Similarity search - Function
MHC class I-like antigen recognition-like / Murine Class I Major Histocompatibility Complex, H2-DB; Chain A, domain 1 / MHC class I alpha chain, alpha1 alpha2 domains / Class I Histocompatibility antigen, domains alpha 1 and 2 / Beta-2-Microglobulin / MHC class I-like antigen recognition-like / MHC class I-like antigen recognition-like superfamily / MHC classes I/II-like antigen recognition protein / Immunoglobulin/major histocompatibility complex, conserved site / Immunoglobulins and major histocompatibility complex proteins signature. ...MHC class I-like antigen recognition-like / Murine Class I Major Histocompatibility Complex, H2-DB; Chain A, domain 1 / MHC class I alpha chain, alpha1 alpha2 domains / Class I Histocompatibility antigen, domains alpha 1 and 2 / Beta-2-Microglobulin / MHC class I-like antigen recognition-like / MHC class I-like antigen recognition-like superfamily / 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 / Immunoglobulins / Immunoglobulin-like fold / Immunoglobulin-like / Sandwich / 2-Layer Sandwich / Mainly Beta / Alpha Beta
Similarity search - Domain/homology
2,4-diaminopteridine-6-carbaldehyde / ACETATE ION / Beta-2-microglobulin / Major histocompatibility complex class I-related gene protein
Similarity search - Component
Biological speciesHomo sapiens (human)
MethodX-RAY DIFFRACTION / SYNCHROTRON / MOLECULAR REPLACEMENT / molecular replacement / Resolution: 2.15 Å
AuthorsKeller, A.N. / Rossjohn, J.
Funding support Australia, 2items
OrganizationGrant numberCountry
Australian Research Council (ARC)CE140100011 Australia
Australian Research Council (ARC)AF50 Australia
CitationJournal: Nat. Immunol. / Year: 2017
Title: Drugs and drug-like molecules can modulate the function of mucosal-associated invariant T cells.
Authors: Keller, A.N. / Eckle, S.B. / Xu, W. / Liu, L. / Hughes, V.A. / Mak, J.Y. / Meehan, B.S. / Pediongco, T. / Birkinshaw, R.W. / Chen, Z. / Wang, H. / D'Souza, C. / Kjer-Nielsen, L. / Gherardin, ...Authors: Keller, A.N. / Eckle, S.B. / Xu, W. / Liu, L. / Hughes, V.A. / Mak, J.Y. / Meehan, B.S. / Pediongco, T. / Birkinshaw, R.W. / Chen, Z. / Wang, H. / D'Souza, C. / Kjer-Nielsen, L. / Gherardin, N.A. / Godfrey, D.I. / Kostenko, L. / Corbett, A.J. / Purcell, A.W. / Fairlie, D.P. / McCluskey, J. / Rossjohn, J.
History
DepositionNov 28, 2016Deposition site: RCSB / Processing site: RCSB
Revision 1.0Feb 8, 2017Provider: repository / Type: Initial release
Revision 1.1Nov 22, 2017Group: Data collection / Refinement description / Category: diffrn_source / software / Item: _diffrn_source.pdbx_synchrotron_site
Revision 1.2Apr 18, 2018Group: Data collection / Database references / Category: citation / citation_author
Item: _citation.journal_abbrev / _citation.journal_id_CSD ..._citation.journal_abbrev / _citation.journal_id_CSD / _citation.journal_volume / _citation.page_first / _citation.page_last / _citation.pdbx_database_id_PubMed / _citation.title
Revision 1.3Jan 1, 2020Group: Author supporting evidence / Category: pdbx_audit_support / Item: _pdbx_audit_support.funding_organization
Revision 1.4Oct 4, 2023Group: Data collection / Database references ...Data collection / Database references / Derived calculations / Refinement description
Category: chem_comp_atom / chem_comp_bond ...chem_comp_atom / chem_comp_bond / database_2 / diffrn_radiation_wavelength / pdbx_initial_refinement_model / pdbx_struct_conn_angle / struct_conn
Item: _database_2.pdbx_DOI / _database_2.pdbx_database_accession ..._database_2.pdbx_DOI / _database_2.pdbx_database_accession / _pdbx_struct_conn_angle.ptnr1_auth_seq_id / _pdbx_struct_conn_angle.ptnr3_auth_seq_id / _pdbx_struct_conn_angle.value / _struct_conn.pdbx_dist_value / _struct_conn.ptnr1_auth_asym_id / _struct_conn.ptnr1_auth_comp_id / _struct_conn.ptnr1_auth_seq_id / _struct_conn.ptnr1_label_asym_id / _struct_conn.ptnr1_label_atom_id / _struct_conn.ptnr1_label_comp_id / _struct_conn.ptnr1_label_seq_id / _struct_conn.ptnr2_auth_asym_id / _struct_conn.ptnr2_auth_comp_id / _struct_conn.ptnr2_auth_seq_id / _struct_conn.ptnr2_label_asym_id / _struct_conn.ptnr2_label_atom_id / _struct_conn.ptnr2_label_comp_id

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Structure visualization

Structure viewerMolecule:
MolmilJmol/JSmol

Downloads & links

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Assembly

Deposited unit
A: Major histocompatibility complex class I-related gene protein
B: MAIT T-cell receptor alpha chain
C: Major histocompatibility complex class I-related gene protein
D: MAIT T-cell receptor alpha chain
E: MAIT T-cell receptor beta chain
F: Beta-2-microglobulin
G: MAIT T-cell receptor beta chain
H: Beta-2-microglobulin
hetero molecules


Theoretical massNumber of molelcules
Total (without water)188,70924
Polymers187,3138
Non-polymers1,39616
Water15,889882
1
A: Major histocompatibility complex class I-related gene protein
B: MAIT T-cell receptor alpha chain
G: MAIT T-cell receptor beta chain
H: Beta-2-microglobulin
hetero molecules


Theoretical massNumber of molelcules
Total (without water)94,26111
Polymers93,6564
Non-polymers6057
Water724
TypeNameSymmetry operationNumber
identity operation1_555x,y,z1
Buried area9820 Å2
ΔGint-63 kcal/mol
Surface area36310 Å2
MethodPISA
2
C: Major histocompatibility complex class I-related gene protein
D: MAIT T-cell receptor alpha chain
E: MAIT T-cell receptor beta chain
F: Beta-2-microglobulin
hetero molecules


Theoretical massNumber of molelcules
Total (without water)94,44813
Polymers93,6564
Non-polymers7929
Water724
TypeNameSymmetry operationNumber
identity operation1_555x,y,z1
Buried area10230 Å2
ΔGint-53 kcal/mol
Surface area36400 Å2
MethodPISA
Unit cell
Length a, b, c (Å)215.288, 69.740, 142.359
Angle α, β, γ (deg.)90.000, 104.020, 90.000
Int Tables number5
Space group name H-MC121

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Components

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Protein , 2 types, 4 molecules ACFH

#1: Protein Major histocompatibility complex class I-related gene protein / MHC class I-related gene protein / Class I histocompatibility antigen-like protein


Mass: 31711.670 Da / Num. of mol.: 2 / Fragment: UNP residues 23-292
Source method: isolated from a genetically manipulated source
Details: Fragment: extracellular domain, residues 23-292 / Source: (gene. exp.) Homo sapiens (human) / Gene: MR1 / Plasmid: pET30 / Production host: Escherichia coli (E. coli) / Strain (production host): BL21(DE3) / References: UniProt: Q95460
#4: Protein Beta-2-microglobulin / Beta-2 microglobulin


Mass: 11748.160 Da / Num. of mol.: 2 / Fragment: UNP residues 21-119
Source method: isolated from a genetically manipulated source
Source: (gene. exp.) Homo sapiens (human) / Gene: B2M, CDABP0092, HDCMA22P / Plasmid: pET30 / Production host: Escherichia coli (E. coli) / Strain (production host): BL21(DE3) / References: UniProt: P61769

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MAIT T-cell receptor ... , 2 types, 4 molecules BDEG

#2: Protein MAIT T-cell receptor alpha chain


Mass: 22650.072 Da / Num. of mol.: 2
Source method: isolated from a genetically manipulated source
Source: (gene. exp.) Homo sapiens (human) / Gene: B2M / Plasmid: pET30 / Production host: Escherichia coli (E. coli) / Strain (production host): BL21(DE3)
#3: Protein MAIT T-cell receptor beta chain


Mass: 27546.562 Da / Num. of mol.: 2
Source method: isolated from a genetically manipulated source
Source: (gene. exp.) Homo sapiens (human) / Gene: TRAV/TRAC / Plasmid: pET30 / Production host: Escherichia coli (E. coli) / Strain (production host): BL21(DE3)

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Non-polymers , 5 types, 898 molecules

#5: Chemical ChemComp-7WP / 2,4-diaminopteridine-6-carbaldehyde


Mass: 190.162 Da / Num. of mol.: 2 / Source method: obtained synthetically / Formula: C7H6N6O
#6: Chemical
ChemComp-GOL / GLYCEROL / GLYCERIN / PROPANE-1,2,3-TRIOL / Glycerol


Mass: 92.094 Da / Num. of mol.: 9 / Source method: obtained synthetically / Formula: C3H8O3
#7: Chemical ChemComp-ACT / ACETATE ION / Acetate


Mass: 59.044 Da / Num. of mol.: 2 / Source method: obtained synthetically / Formula: C2H3O2
#8: Chemical ChemComp-NA / SODIUM ION


Mass: 22.990 Da / Num. of mol.: 3 / Source method: obtained synthetically / Formula: Na
#9: Water ChemComp-HOH / water / Water


Mass: 18.015 Da / Num. of mol.: 882 / Source method: isolated from a natural source / Formula: H2O

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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: 2.77 Å3/Da / Density % sol: 55.56 % / Mosaicity: 0.51 °
Crystal growTemperature: 294 K / Method: vapor diffusion, hanging drop / pH: 6.5 / Details: BTP, PEG 3350, NaAc

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Data collection

DiffractionMean temperature: 100 K
Diffraction sourceSource: SYNCHROTRON / Site: Australian Synchrotron / Beamline: MX2 / Wavelength: 0.953 Å
DetectorType: ADSC QUANTUM 315r / Detector: CCD / Date: Mar 22, 2015
RadiationProtocol: SINGLE WAVELENGTH / Monochromatic (M) / Laue (L): M / Scattering type: x-ray
Radiation wavelengthWavelength: 0.953 Å / Relative weight: 1
ReflectionResolution: 2.15→45.346 Å / Num. obs: 111804 / % possible obs: 100 % / Redundancy: 4.4 % / CC1/2: 0.995 / Rmerge(I) obs: 0.115 / Rpim(I) all: 0.062 / Rrim(I) all: 0.131 / Net I/σ(I): 8.5 / Num. measured all: 489218 / Scaling rejects: 97
Reflection shellResolution: 2.15→2.19 Å / Redundancy: 4.4 % / Rmerge(I) obs: 0.914 / CC1/2: 0.661 / % possible all: 100

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Phasing

PhasingMethod: molecular replacement

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Processing

Software
NameVersionClassification
MOSFLMdata reduction
Aimless0.3.11data scaling
PHASERphasing
PDB_EXTRACT3.2data extraction
PHENIXrefinement
RefinementMethod to determine structure: MOLECULAR REPLACEMENT
Starting model: 4L4T

4l4t


Resolution: 2.15→45.346 Å / SU ML: 0.25 / Cross valid method: FREE R-VALUE / σ(F): 1.34 / Phase error: 24.15
RfactorNum. reflection% reflection
Rfree0.2239 5604 5.01 %
Rwork0.1799 --
obs0.1822 111764 99.95 %
Solvent computationShrinkage radii: 0.9 Å / VDW probe radii: 1.11 Å
Displacement parametersBiso max: 113.27 Å2 / Biso mean: 40.8296 Å2 / Biso min: 17.61 Å2
Refinement stepCycle: final / Resolution: 2.15→45.346 Å
ProteinNucleic acidLigandSolventTotal
Num. atoms12770 0 91 882 13743
Biso mean--44.76 40.61 -
Num. residues----1602
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)
11.3290.0864-0.07262.69730.50881.81920.0402-0.13620.0132-0.0552-0.0851-0.1865-0.02180.0090.05570.16680.01960.0250.23640.0470.23547.394323.1641252.2361
20.79060.3864-0.44870.5894-0.11680.96220.01480.0120.0069-0.0256-0.0564-0.0192-0.095-0.08520.03710.25160.065-0.03430.25190.01560.25717.391824.4386238.3686
32.5112-0.30120.17562.8281-0.74122.5040.03130.3337-0.2545-0.2822-0.05850.00850.27970.06070.02970.32390.0027-0.00660.193-0.0190.347821.869933.0396222.613
42.3434-0.3362-1.02480.4428-0.32142.9337-0.03720.06560.02370.01690.00050.05490.0876-0.31220.03940.21810.0256-0.01730.3552-0.0630.2581-26.362723.4848255.1962
52.11030.1006-1.56020.8648-0.15281.74880.05320.06940.06910.12420.02170.24670.1319-0.4234-0.08910.28870.003-0.0210.5342-0.06430.354-40.603923.2356269.5519
64.2129-0.216-0.0792.85490.15654.40520.03320.18840.60040.09090.13430.3371-0.1005-0.5714-0.12880.373-0.00410.0620.5320.00230.489-51.842325.4424275.8324
71.91720.21730.15341.6842-0.28911.3805-0.0129-0.05760.19730.10380.05020.0116-0.0122-0.0423-0.0360.21880.04610.0120.2277-0.0190.2291-43.856540.7549186.8849
80.3623-0.71120.36441.7206-0.64091.29110.2215-0.0368-0.15110.161-0.0456-0.24260.19420.0121-0.17040.23760.03550.01240.2487-0.01750.221-40.309632.8898181.0216
91.342-0.18650.36581.3392-0.13122.4332-0.08150.36190.5876-0.22380.04230.1024-0.45360.28430.03240.2916-0.1019-0.04970.53060.15510.5148-65.239841.9169159.3213
102.6517-1.50221.7230.9978-0.91411.16070.0122-0.0348-0.03450.02430.0151-0.0550.03850.0115-0.03790.3470.0454-0.03670.2377-0.03320.2725-16.899618.6961194.271
113.1437-0.457-0.55521.20750.27543.85060.03380.0899-0.32650.48170.0150.01050.3687-0.1785-0.01580.49010.0086-0.05070.2027-0.03140.32171.26196.6867216.2384
126.31890.90870.89974.15491.39464.28310.06830.1539-0.46520.5881-0.04-0.11470.7823-0.0079-0.03290.5130.0061-0.0580.2626-0.06470.39647.0772-2.0784211.8421
131.7217-0.55750.50622.0643-1.6051.9404-0.0608-0.4480.11550.55550.0173-0.0694-0.3301-0.2820.04150.47090.0697-0.05940.3692-0.04760.2388-30.90428.7682212.551
142.9679-0.2031-2.56635.0890.60442.25010.07460.13310.1359-0.4036-0.01610.0816-0.08940.0252-0.03460.41440.038-0.07870.2459-0.02930.2948-26.662533.4902199.608
154.7929-0.86751.30571.8706-0.24813.44860.24890.3447-0.4442-0.43960.08240.26980.7738-0.7802-0.31560.4885-0.0616-0.06570.40890.04790.3157-22.807415.7807227.098
162.66190.7105-0.80141.34920.60071.30690.23470.0015-0.10530.0779-0.1403-0.0307-0.2414-0.0519-0.11290.42510.0611-0.03550.21970.00510.25811.011615.654221.0913
173.0561-0.1545-1.48972.5764-0.45344.0078-0.12980.79630.0406-0.26660.15060.36340.1181-0.8751-0.00870.40510.0702-0.03920.3427-0.040.257-8.895814.0507218.9311
182.2744-0.1493-1.13360.4957-0.39480.98840.2471-0.06430.31750.1697-0.0696-0.124-0.3491-0.091-0.16070.44690.058-0.04040.2284-0.05180.27664.446120.4724221.4914
193.20720.6446-1.51250.9547-0.15941.92410.22260.04490.05450.1026-0.1011-0.0104-0.2027-0.1609-0.09780.37680.038-0.04870.2813-0.05650.2396-12.205920.8724233.152
200.3639-0.5101-0.10091.79680.341.9894-0.185-0.30090.0492-0.4709-0.03820.3404-0.1261-0.51920.19640.26150.0339-0.06770.45820.09230.6874-67.528648.9543175.5749
210.5343-0.3249-0.01190.2259-0.17591.01150.14050.18540.12130.0597-0.04830.5549-0.0338-0.498-0.08330.24280.0656-0.0010.5595-0.05230.6491-67.145446.9926179.2422
229.9206-0.03191.30690.3289-0.46760.8057-0.1569-0.43040.81370.3984-0.15510.3869-0.2403-0.54580.27860.40850.11850.04510.4611-0.1230.7055-63.107354.6893185.9347
230.9592-0.30060.20222.9569-0.1232.53250.0285-0.30730.7030.1650.10060.1366-0.4525-0.3261-0.1460.23720.36310.26271.0728-0.23241.0258-77.048956.2744186.8172
240.1013-0.39690.31946.24862.1083.41050.1995-0.2191-0.16450.73690.00770.77440.2574-0.2241-0.17740.33070.13110.0731.0140.12180.7219-70.473946.0061189.7376
252.5671.8404-2.78912.63-1.25813.4718-0.05140.21420.19970.07930.04610.00220.2308-0.3770.02890.23020.03740.00240.3117-0.03310.3313-51.888645.4886181.7694
263.6189-1.57621.71111.20060.11542.2214-0.399-0.35560.10040.6510.30260.72290.1369-0.77370.10150.32670.03280.1250.60580.00780.6002-67.733445.7367182.8746
271.673-0.634-0.6680.37250.0611.3237-0.0368-0.23530.33230.09730.2173-0.0095-0.1668-0.0941-0.12250.24220.119-0.19351.349-0.10771.3677-83.709152.6107177.1954
281.7311-0.45610.58480.1519-0.32111.1003-0.1313-0.14260.55750.32320.05030.646-0.2007-0.32530.06790.38590.0974-0.00070.4764-0.13941.0918-64.380159.6709182.8784
291.93940.1089-2.65995.3484-1.61634.0521-0.28070.32440.5951-0.59830.43920.0289-0.0978-0.5903-0.16130.5750.1566-0.19210.54540.07780.8417-72.895555.4155174.6177
302.8679-0.0505-1.01481.5533-0.12062.2783-0.0586-0.2159-0.08020.3139-0.1196-0.05470.01270.23690.16430.28330.016-0.00790.3865-0.01840.2447-10.585223.1395275.1151
312.6188-0.4843-0.75272.72181.5943.95780.1862-0.05970.13160.1204-0.0289-0.41410.18660.2596-0.13250.22250.05030.01080.2668-0.0230.2491-12.788222.5184271.5456
325.0139-0.4032-3.70510.5411-0.38333.66280.2307-0.38530.65470.21140.080.07820.02590.2794-0.25730.3854-0.06950.08680.4116-0.10130.345-25.515928.8661290.7442
332.4159-0.26091.29081.46750.60892.66850.1943-0.0819-0.40770.00770.05520.12140.3211-0.3939-0.25650.3935-0.08760.05060.36050.02280.3607-43.7717.793282.9693
341.1779-0.5008-1.2082.43920.31922.22140.5441-0.7555-0.72630.4922-0.0208-0.13030.7837-0.0745-0.49170.5911-0.0396-0.05540.45590.12320.4707-33.184214.7939292.1697
355.5540.66840.33111.8772-0.27682.06460.6093-0.865-0.44590.7006-0.13890.21210.619-0.682-0.44490.572-0.07320.03530.52790.14760.3613-35.848416.6898296.0652
362.44520.349-0.03022.4468-0.29072.5891-0.0299-0.0490.15540.2115-0.1464-0.444-0.42630.23080.09840.2389-0.0107-0.01060.20420.05060.288929.655429.9339240.4126
375.09193.0328-0.66755.1357-0.59662.49260.0456-0.5894-0.22050.5069-0.1044-0.4026-0.08330.30920.07960.28110.0146-0.03290.31160.00870.281633.582525.5008250.5686
387.32190.7331.39875.4232-0.0425.4864-0.0759-0.52750.45880.83830.22540.0172-0.35520.5115-0.12430.43830.01090.00270.3977-0.00940.31824.771731.0798251.6342
395.48953.1664-0.13824.6095-0.87721.9465-0.2049-0.10760.25360.07610.0507-0.1073-0.11790.28290.15490.28640.037-0.00270.2550.02780.270829.097730.3534243.6639
403.59491.3983-0.61563.54990.31032.1126-0.13160.0710.0348-0.0072-0.0457-0.3636-0.22730.38290.14610.25710.0193-0.02460.28570.08210.345836.048523.3461243.5215
Refinement TLS group
IDRefine-IDRefine TLS-IDSelection detailsAuth asym-IDAuth seq-ID
1X-RAY DIFFRACTION1chain 'A' and (resid 1 through 114 )A1 - 114
2X-RAY DIFFRACTION2chain 'A' and (resid 115 through 205 )A115 - 205
3X-RAY DIFFRACTION3chain 'A' and (resid 206 through 269 )A206 - 269
4X-RAY DIFFRACTION4chain 'B' and (resid 1 through 91 )B1 - 91
5X-RAY DIFFRACTION5chain 'B' and (resid 92 through 135 )B92 - 135
6X-RAY DIFFRACTION6chain 'B' and (resid 136 through 199 )B136 - 199
7X-RAY DIFFRACTION7chain 'C' and (resid 0 through 133 )C0 - 133
8X-RAY DIFFRACTION8chain 'C' and (resid 134 through 182 )C134 - 182
9X-RAY DIFFRACTION9chain 'C' and (resid 183 through 269 )C183 - 269
10X-RAY DIFFRACTION10chain 'D' and (resid 1 through 120 )D1 - 120
11X-RAY DIFFRACTION11chain 'D' and (resid 121 through 185 )D121 - 185
12X-RAY DIFFRACTION12chain 'D' and (resid 186 through 200 )D186 - 200
13X-RAY DIFFRACTION13chain 'E' and (resid 1 through 94 )E1 - 94
14X-RAY DIFFRACTION14chain 'E' and (resid 95 through 109 )E95 - 109
15X-RAY DIFFRACTION15chain 'E' and (resid 110 through 124 )E110 - 124
16X-RAY DIFFRACTION16chain 'E' and (resid 125 through 162 )E125 - 162
17X-RAY DIFFRACTION17chain 'E' and (resid 163 through 188 )E163 - 188
18X-RAY DIFFRACTION18chain 'E' and (resid 189 through 215 )E189 - 215
19X-RAY DIFFRACTION19chain 'E' and (resid 216 through 244 )E216 - 244
20X-RAY DIFFRACTION20chain 'F' and (resid 1 through 19 )F1 - 19
21X-RAY DIFFRACTION21chain 'F' and (resid 20 through 30 )F20 - 30
22X-RAY DIFFRACTION22chain 'F' and (resid 31 through 41 )F31 - 41
23X-RAY DIFFRACTION23chain 'F' and (resid 42 through 46 )F42 - 46
24X-RAY DIFFRACTION24chain 'F' and (resid 47 through 51 )F47 - 51
25X-RAY DIFFRACTION25chain 'F' and (resid 52 through 61 )F52 - 61
26X-RAY DIFFRACTION26chain 'F' and (resid 62 through 71 )F62 - 71
27X-RAY DIFFRACTION27chain 'F' and (resid 72 through 77 )F72 - 77
28X-RAY DIFFRACTION28chain 'F' and (resid 78 through 90 )F78 - 90
29X-RAY DIFFRACTION29chain 'F' and (resid 91 through 97 )F91 - 97
30X-RAY DIFFRACTION30chain 'G' and (resid 3 through 73 )G3 - 73
31X-RAY DIFFRACTION31chain 'G' and (resid 74 through 109 )G74 - 109
32X-RAY DIFFRACTION32chain 'G' and (resid 110 through 124 )G110 - 124
33X-RAY DIFFRACTION33chain 'G' and (resid 125 through 203 )G125 - 203
34X-RAY DIFFRACTION34chain 'G' and (resid 204 through 225 )G204 - 225
35X-RAY DIFFRACTION35chain 'G' and (resid 226 through 243 )G226 - 243
36X-RAY DIFFRACTION36chain 'H' and (resid 1 through 30 )H1 - 30
37X-RAY DIFFRACTION37chain 'H' and (resid 31 through 46 )H31 - 46
38X-RAY DIFFRACTION38chain 'H' and (resid 47 through 56 )H47 - 56
39X-RAY DIFFRACTION39chain 'H' and (resid 57 through 77 )H57 - 77
40X-RAY DIFFRACTION40chain 'H' and (resid 78 through 99 )H78 - 99

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