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- PDB-9nw9: CA117v2v8 Fab bound to HLA-E-RL9HIV -

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Basic information

Entry
Database: PDB / ID: 9nw9
TitleCA117v2v8 Fab bound to HLA-E-RL9HIV
Components
  • Beta-2-microglobulin
  • CA117v2v8 heavy chain
  • CA117v2v8 light chain
  • HLA class I histocompatibility antigen, alpha chain E
  • RL9HIV peptide
KeywordsIMMUNE SYSTEM / HLA-E / antibody / NKG2a / CD94 / HIV-1
Function / homology
Function and homology information


positive regulation of antibody-dependent cellular cytotoxicity / regulation of natural killer cell mediated immunity / positive regulation of TRAIL production / antigen processing and presentation of exogenous peptide antigen via MHC class Ib / positive regulation of natural killer cell mediated immunity / positive regulation of natural killer cell cytokine production / natural killer cell tolerance induction / negative regulation of natural killer cell activation / positive regulation of natural killer cell activation / MHC class Ib protein complex ...positive regulation of antibody-dependent cellular cytotoxicity / regulation of natural killer cell mediated immunity / positive regulation of TRAIL production / antigen processing and presentation of exogenous peptide antigen via MHC class Ib / positive regulation of natural killer cell mediated immunity / positive regulation of natural killer cell cytokine production / natural killer cell tolerance induction / negative regulation of natural killer cell activation / positive regulation of natural killer cell activation / MHC class Ib protein complex / natural killer cell lectin-like receptor binding / positive regulation of interleukin-13 production / positive regulation of natural killer cell mediated cytotoxicity / negative regulation of natural killer cell mediated cytotoxicity / positive regulation of CD8-positive, alpha-beta T cell activation / CD8-positive, alpha-beta T cell activation / positive regulation of CD8-positive, alpha-beta T cell proliferation / positive regulation of immunoglobulin production / positive regulation of interleukin-4 production / protection from natural killer cell mediated cytotoxicity / positive regulation of natural killer cell proliferation / beta-2-microglobulin binding / MHC class I protein binding / antigen processing and presentation of endogenous peptide antigen via MHC class Ib / antigen processing and presentation of endogenous peptide antigen via MHC class I via ER pathway, TAP-independent / negative regulation of T cell proliferation / T cell receptor binding / early endosome lumen / Nef mediated downregulation of MHC class I complex cell surface expression / DAP12 interactions / Endosomal/Vacuolar pathway / T cell mediated cytotoxicity / HIV-1 retropepsin / symbiont-mediated activation of host apoptosis / Antigen Presentation: Folding, assembly and peptide loading of class I MHC / retroviral ribonuclease H / exoribonuclease H / lumenal side of endoplasmic reticulum membrane / regulation of iron ion transport / cellular response to iron(III) ion / negative regulation of iron ion transport / negative regulation of forebrain neuron differentiation / antigen processing and presentation of exogenous protein antigen via MHC class Ib, TAP-dependent / exoribonuclease H activity / ER to Golgi transport vesicle membrane / peptide antigen assembly with MHC class I protein complex / regulation of erythrocyte differentiation / response to molecule of bacterial origin / HFE-transferrin receptor complex / transferrin transport / MHC class I peptide loading complex / cellular response to iron ion / negative regulation of receptor-mediated endocytosis / positive regulation of T cell cytokine production / antigen processing and presentation of endogenous peptide antigen via MHC class I / DNA integration / MHC class I protein complex / peptide antigen assembly with MHC class II protein complex / viral genome integration into host DNA / negative regulation of neurogenesis / cellular response to nicotine / positive regulation of receptor-mediated endocytosis / MHC class II protein complex / establishment of integrated proviral latency / RNA-directed DNA polymerase / multicellular organismal-level iron ion homeostasis / positive regulation of T cell mediated cytotoxicity / RNA stem-loop binding / viral penetration into host nucleus / specific granule lumen / positive regulation of immune response / antigen processing and presentation of exogenous peptide antigen via MHC class II / host multivesicular body / peptide antigen binding / phagocytic vesicle membrane / RNA-directed DNA polymerase activity / recycling endosome membrane / RNA-DNA hybrid ribonuclease activity / positive regulation of T cell activation / negative regulation of epithelial cell proliferation / Interferon gamma signaling / Immunoregulatory interactions between a Lymphoid and a non-Lymphoid cell / Transferases; Transferring phosphorus-containing groups; Nucleotidyltransferases / positive regulation of tumor necrosis factor production / Interferon alpha/beta signaling / Modulation by Mtb of host immune system / sensory perception of smell / positive regulation of cellular senescence / tertiary granule lumen / DAP12 signaling / MHC class II protein complex binding / T cell differentiation in thymus / late endosome membrane / host cell / negative regulation of neuron projection development / antibacterial humoral response / ER-Phagosome pathway / protein refolding / viral nucleocapsid / early endosome membrane
Similarity search - Function
MHC class I, alpha chain, C-terminal / MHC_I C-terminus / MHC class I alpha chain, alpha1 alpha2 domains / Class I Histocompatibility antigen, domains alpha 1 and 2 / Reverse transcriptase connection / Reverse transcriptase connection domain / Reverse transcriptase thumb / Reverse transcriptase thumb domain / Beta-2-Microglobulin / Integrase Zinc binding domain ...MHC class I, alpha chain, C-terminal / MHC_I C-terminus / MHC class I alpha chain, alpha1 alpha2 domains / Class I Histocompatibility antigen, domains alpha 1 and 2 / Reverse transcriptase connection / Reverse transcriptase connection domain / Reverse transcriptase thumb / Reverse transcriptase thumb domain / Beta-2-Microglobulin / Integrase Zinc binding domain / Zinc finger integrase-type profile. / : / Integrase DNA binding domain / Integrase, C-terminal domain superfamily, retroviral / MHC class I-like antigen recognition-like / Integrase, N-terminal zinc-binding domain / Integrase-like, N-terminal / MHC class I-like antigen recognition-like superfamily / Integrase, C-terminal, retroviral / Integrase DNA binding domain profile. / Immunodeficiency lentiviral matrix, N-terminal / gag gene protein p17 (matrix protein) / RNase H / Integrase core domain / Integrase, catalytic core / Integrase catalytic domain profile. / Retropepsin-like catalytic domain / Matrix protein, lentiviral and alpha-retroviral, N-terminal / RNase H type-1 domain profile. / Ribonuclease H domain / Retroviral nucleocapsid Gag protein p24, C-terminal domain / Gag protein p24 C-terminal domain / MHC classes I/II-like antigen recognition protein / Retropepsins / Retroviral aspartyl protease / : / Aspartyl protease, retroviral-type family profile. / Peptidase A2A, retrovirus, catalytic / Reverse transcriptase (RNA-dependent DNA polymerase) / Retrovirus capsid, C-terminal / Reverse transcriptase domain / Reverse transcriptase (RT) catalytic domain profile. / Retroviral matrix protein / Retrovirus capsid, N-terminal / zinc finger / Zinc knuckle / Zinc finger, CCHC-type superfamily / Zinc finger, CCHC-type / Zinc finger CCHC-type profile. / Immunoglobulin/major histocompatibility complex, conserved site / Immunoglobulins and major histocompatibility complex proteins signature. / Immunoglobulin C-Type / Immunoglobulin C1-set / Immunoglobulin C1-set domain / Aspartic peptidase, active site / Eukaryotic and viral aspartyl proteases active site. / Aspartic peptidase domain superfamily / Ribonuclease H superfamily / Ribonuclease H-like superfamily / Reverse transcriptase/Diguanylate cyclase domain / Ig-like domain profile. / Immunoglobulin-like domain / Immunoglobulin-like domain superfamily / Immunoglobulin-like fold / DNA/RNA polymerase superfamily
Similarity search - Domain/homology
Gag-Pol polyprotein / HLA class I histocompatibility antigen, alpha chain E / Beta-2-microglobulin
Similarity search - Component
Biological speciesHomo sapiens (human)
Human immunodeficiency virus 1
MethodX-RAY DIFFRACTION / SYNCHROTRON / MOLECULAR REPLACEMENT / Resolution: 2.3 Å
AuthorsWrapp, D. / Hwang, J.K. / Marston, D.J. / Haynes, B.F. / Azoitei, M.L.
Funding support United States, 1items
OrganizationGrant numberCountry
National Institutes of Health/National Institute Of Allergy and Infectious Diseases (NIH/NIAID)UM1AI164567 United States
CitationJournal: To Be Published
Title: HLA-E-VL9 antibodies mediate NKG2A+ NK cell and CD8+ T cell killing of HIV-infected CD4+ T cells
Authors: Hwang, J.K. / Marston, D.J. / Tuyishime, M. / Yang, H. / Wrapp, D. / Li, D. / Brackenridge, S. / Frazier, M. / Rhodes, B. / Harris, C. / Quastel, M. / Kapingidza, A.B. / Gater, J. / Borrow, ...Authors: Hwang, J.K. / Marston, D.J. / Tuyishime, M. / Yang, H. / Wrapp, D. / Li, D. / Brackenridge, S. / Frazier, M. / Rhodes, B. / Harris, C. / Quastel, M. / Kapingidza, A.B. / Gater, J. / Borrow, P. / Gillespie, G.M. / Ferrari, G. / McMichael, A.J. / Haynes, B.F. / Azoitei, M.L.
History
DepositionMar 21, 2025Deposition site: RCSB / Processing site: RCSB
Revision 1.0Mar 25, 2026Provider: repository / Type: Initial release

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Structure visualization

Structure viewerMolecule:
MolmilJmol/JSmol

Downloads & links

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Assembly

Deposited unit
A: HLA class I histocompatibility antigen, alpha chain E
B: Beta-2-microglobulin
H: CA117v2v8 heavy chain
L: CA117v2v8 light chain
P: RL9HIV peptide


Theoretical massNumber of molelcules
Total (without water)92,5855
Polymers92,5855
Non-polymers00
Water2,180121
1


  • Idetical with deposited unit
  • defined by author
TypeNameSymmetry operationNumber
identity operation1_555x,y,z1
Unit cell
Length a, b, c (Å)57.540, 72.520, 122.350
Angle α, β, γ (deg.)90.000, 100.790, 90.000
Int Tables number4
Space group name H-MP1211
Space group name HallP2yb
Symmetry operation#1: x,y,z
#2: -x,y+1/2,-z

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Components

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Protein , 2 types, 2 molecules AB

#1: Protein HLA class I histocompatibility antigen, alpha chain E / MHC class I antigen E


Mass: 31728.910 Da / Num. of mol.: 1
Source method: isolated from a genetically manipulated source
Source: (gene. exp.) Homo sapiens (human) / Gene: HLA-E, HLA-6.2, HLAE / Production host: Escherichia coli (E. coli) / References: UniProt: P13747
#2: Protein Beta-2-microglobulin


Mass: 11879.356 Da / Num. of mol.: 1 / Fragment: UNP residues 21-119
Source method: isolated from a genetically manipulated source
Source: (gene. exp.) Homo sapiens (human) / Gene: B2M, CDABP0092, HDCMA22P / Production host: Escherichia coli (E. coli) / References: UniProt: P61769

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Antibody , 2 types, 2 molecules HL

#3: Antibody CA117v2v8 heavy chain


Mass: 24754.816 Da / Num. of mol.: 1
Source method: isolated from a genetically manipulated source
Source: (gene. exp.) Homo sapiens (human) / Production host: Homo sapiens (human)
#4: Antibody CA117v2v8 light chain


Mass: 23153.539 Da / Num. of mol.: 1
Source method: isolated from a genetically manipulated source
Source: (gene. exp.) Homo sapiens (human) / Production host: Homo sapiens (human)

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Protein/peptide / Non-polymers , 2 types, 122 molecules P

#5: Protein/peptide RL9HIV peptide / CA


Mass: 1068.268 Da / Num. of mol.: 1 / Source method: obtained synthetically / Source: (synth.) Human immunodeficiency virus 1 / References: UniProt: P03366
#6: Water ChemComp-HOH / water


Mass: 18.015 Da / Num. of mol.: 121 / Source method: isolated from a natural source / Formula: H2O

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Details

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: 2.71 Å3/Da / Density % sol: 54.59 %
Crystal growTemperature: 293 K / Method: vapor diffusion, sitting drop / Details: 0.2 M magnesium chloride, 20% PEG 3350

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Data collection

DiffractionMean temperature: 80 K / Serial crystal experiment: N
Diffraction sourceSource: SYNCHROTRON / Site: APS / Beamline: 22-BM / Wavelength: 1 Å
DetectorType: RAYONIX MX-225 / Detector: CCD / Date: Nov 3, 2022
RadiationProtocol: SINGLE WAVELENGTH / Monochromatic (M) / Laue (L): M / Scattering type: x-ray
Radiation wavelengthWavelength: 1 Å / Relative weight: 1
ReflectionResolution: 2.3→73.52 Å / Num. obs: 43168 / % possible obs: 98 % / Redundancy: 3.8 % / Biso Wilson estimate: 50.05 Å2 / CC1/2: 0.998 / Net I/σ(I): 13.9
Reflection shellResolution: 2.3→2.38 Å / Mean I/σ(I) obs: 2 / Num. unique obs: 4132 / CC1/2: 0.757

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Processing

Software
NameVersionClassification
PHENIXdev_3758refinement
PHENIXdev_3758refinement
MOSFLMdata reduction
Aimlessdata scaling
PHASERphasing
RefinementMethod to determine structure: MOLECULAR REPLACEMENT / Resolution: 2.3→46.27 Å / SU ML: 0.3326 / Cross valid method: FREE R-VALUE / σ(F): 1.34 / Phase error: 27.528
Stereochemistry target values: GeoStd + Monomer Library + CDL v1.2
RfactorNum. reflection% reflection
Rfree0.239 2157 5 %
Rwork0.1912 40975 -
obs0.1935 43132 97.68 %
Solvent computationShrinkage radii: 0.9 Å / VDW probe radii: 1.11 Å / Solvent model: FLAT BULK SOLVENT MODEL
Displacement parametersBiso mean: 62.81 Å2
Refinement stepCycle: LAST / Resolution: 2.3→46.27 Å
ProteinNucleic acidLigandSolventTotal
Num. atoms6395 0 0 121 6516
Refine LS restraints
Refine-IDTypeDev idealNumber
X-RAY DIFFRACTIONf_bond_d0.01146561
X-RAY DIFFRACTIONf_angle_d0.94378923
X-RAY DIFFRACTIONf_chiral_restr0.0689969
X-RAY DIFFRACTIONf_plane_restr0.00561148
X-RAY DIFFRACTIONf_dihedral_angle_d25.54532366
LS refinement shell
Resolution (Å)Rfactor RfreeNum. reflection RfreeRfactor RworkNum. reflection RworkRefine-ID% reflection obs (%)
2.3-2.350.37141440.30582638X-RAY DIFFRACTION96.56
2.35-2.410.33051300.27822744X-RAY DIFFRACTION97.03
2.41-2.480.35311280.27582673X-RAY DIFFRACTION97.29
2.48-2.550.3121440.28432694X-RAY DIFFRACTION97.33
2.55-2.630.35971550.26962733X-RAY DIFFRACTION97.47
2.63-2.730.3141570.25782712X-RAY DIFFRACTION97.45
2.73-2.840.27081430.23152705X-RAY DIFFRACTION97.5
2.84-2.960.3021390.23072726X-RAY DIFFRACTION97.75
2.97-3.120.28541550.2332708X-RAY DIFFRACTION97.85
3.12-3.320.27821570.22052746X-RAY DIFFRACTION97.88
3.32-3.570.23671560.20132727X-RAY DIFFRACTION98.06
3.57-3.930.24251170.18062766X-RAY DIFFRACTION98.19
3.93-4.50.17931370.14962779X-RAY DIFFRACTION98.31
4.5-5.670.18791270.13462804X-RAY DIFFRACTION98.42
5.67-46.270.18341680.16212820X-RAY DIFFRACTION98.06
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)
16.940066550895.559450056482.937311133738.882353607243.866863758926.45131863051-0.2905188166420.358434927317-0.1424519489430.05874753527490.332949683368-0.436018090787-0.0933019557750.620661687216-0.2097250343460.2713381038910.0152882577789-0.01466115699760.34995860390.004486205552090.302400338527-24.7561927317-11.58763288943.662598199
26.238996200013.721140399-0.7653309177267.31243202006-0.8639221029796.149137989330.200370368134-0.151167566102-1.007145927330.375291324151-0.216491574657-0.90684099370.5987035086960.3500760815790.02261746007640.3680541477250.07155777816087.46340401684E-50.321191032450.02636819067330.471017314346-23.6184305285-23.168779742941.4370080616
32.59136324336-0.625948725753-0.9954564222512.19912957836-0.3411467130061.66253177267-0.03078921671980.121356681466-0.191179248143-0.5529102799290.0350654374-1.13598420163-0.03809221709610.28149043038-0.09340169664670.2724515144430.0100821372250.04266838698620.4589229775190.01383883908890.418201018859-18.2094091426-9.5763552084736.0549269853
42.079435209041.513668193391.426532486024.800797129553.648824344333.375199166460.0442888672308-0.1722302400740.370040553643-0.47963070666-0.3460676644770.615462155084-0.148112231272-0.3887586984410.3976841650340.368433071611-0.000597373470424-0.04984003799330.4293305051980.06680564169010.399791636733-31.7932961206-5.8028095346238.4065854907
57.988722885321.377212842662.061669968666.683137962350.5104795439058.19663742305-0.1268588320220.327988356206-0.0845675458614-0.6027567467370.2325552194040.860223031512-0.135259904222-0.6033362945960.01577101548210.2984599553740.06080513178-0.09931991080770.4573548805051.97250368853E-50.472277045891-34.50048867071.3463805760934.7217125478
63.111272500222.586239328072.96814773989.456656228793.643649862443.059387899580.3684126643441.590895827680.435934466019-2.32844748991-0.00905189365574-0.0453369154141-0.15329382887-0.485946367786-0.3083003741510.7822180207720.00374849810113-0.03421388317590.7066449071180.08638727330010.528413749613-27.87833229115.7093309499329.0533774294
74.551121426312.05737789129-1.874020196718.53984294414-2.622059757945.09179792465-0.4554573475250.95967837331-0.258407031897-1.953378091970.5604853973650.005028250984790.526287981191-0.189073039813-0.1936723566520.591114863624-0.128057704817-0.1341326843340.554411398283-0.07792079900560.452559344372-33.1316701505-17.845351346427.7917399071
85.03548644675-0.301472706986-4.564936563293.482683537140.4390016939958.358993777340.1349370380170.2056321292750.2024359866080.254421032868-0.0448470467320.593768533773-0.259174910256-0.760632522118-0.05498004449810.341885401093-0.03698905898990.0337477120240.4570327068670.06359930494770.554750956633-51.3847031832-20.928434275959.2626169595
94.289248734133.243368566693.154262199033.0924910761.766792306312.979148400910.180571823069-0.6317054309611.32381260519-1.21164000664-1.062630284880.4881237320880.175652225730.3742996302831.076640462490.7423944963130.06306145436760.1014389504730.696297628832-0.01306425947570.655252270922-31.0707446894-0.27021124468156.1872851281
107.022425633543.932751726730.1817140967742.219507843790.2630803873945.60843940730.129883622496-0.984457872295-0.3301284459620.3919297398680.3931858427170.0905458318247-0.0143948171314-1.21974477292-0.3993661383680.341695443111-0.0451532274844-0.02123405567030.6099706721550.01359242848160.378598084554-36.3657800426-17.234494740962.4609435152
115.44879819337-3.612878895643.488441375863.85256543987-0.4214642407924.772085636590.121943046619-0.823245322231-1.62370908331-0.272069344843-0.009015588876190.6923216001630.598799194014-0.567378543299-0.2142575611110.72744272807-0.279953757769-0.2534993098490.7433268510670.2102211382910.851149326578-37.3097236571-32.958258221265.3251671178
123.277088599911.56367125251-1.016865932683.20817046085-4.246474691726.153639248640.323215313089-0.771216184627-0.257872706633-0.132618474416-0.01798453608920.009192317230540.563872890098-0.013046063132-0.1882120257570.387398917074-0.0993844840734-0.06074593989810.5046840895550.1380325684220.378655573064-32.4171556364-19.962975552459.9617866007
134.317169688120.02024114002520.2431749995351.756885558661.595166248361.606287895750.528726339207-0.4902518339460.2187651464430.998308665221-1.43302907649-0.954420693473-0.5775277986531.047298283491.021216443990.365715842771-0.15360283959-0.006901480816310.6115667603370.04508337919080.384549624052-25.0180063497-12.318832769261.7662471981
143.31764825953-1.37763618696-0.6071656593462.04000326421-1.723736425842.620414894280.455112351715-0.110408475945-0.2560709125840.404212621669-0.0291939073527-0.6793615855150.7354645762842.475695807-0.323947321870.514720763796-0.0483906356389-0.1433232249930.7794252942390.1046766791270.730032647215-21.8523524448-22.338723417865.9072107447
153.889105719962.07285699286-1.084556463264.00945441046-4.205828270644.500710991320.306039158608-0.280268107063-0.3482356851080.342666053991-0.1752103639410.0399157409205-0.04037378980460.318289190677-0.2955653362480.367938588548-0.0268583973204-0.06434429601510.400218684511-0.000364840132280.389528676387-30.3486219381-16.137357446253.687411039
162.063760353422.85707542672-0.9193052427969.492020866320.7565934764532.041670188330.378952025986-1.371014499330.1750663680270.0786831864677-0.7834169215460.8831860676820.187400749909-1.422103436920.4827327257720.531234448729-0.06442888815290.004552336959590.9584060278240.343143214330.829355644835-32.8475701422-29.011685318576.2489906928
171.764352399632.16708000626-1.592676114295.14580236626-5.165403778935.66539751750.73456819262-0.698194548867-0.116907659021.38729488942-1.02853416064-0.534178058229-0.9274686320560.7819777383740.3831990223380.573263931552-0.170346440802-0.08395889593560.671489159170.0002174900883870.396427792507-27.2785844865-9.3778181129567.0793966263
183.146689122693.68843539920.2827572153194.45026263045-0.09927599906718.83172707440.826102969796-0.6148694322420.1583992864171.02289216893-0.8904196757171.3411199508-0.0704804690276-1.870638843860.1253116065130.581020463336-0.05549335877680.09816803202190.872117869629-0.008523968319310.528168955708-36.9184185817-19.43784660670.6912026052
193.11904659305-1.63860265629-2.322057168374.41952906578-1.098478407892.98558929172-0.3743286853670.0217037523454-0.247750458765-0.3655624785440.253363666044-0.538473205886-0.2468954082690.4046720114860.08496509547850.359126589243-0.1316693410320.003801069805230.59121745024-0.1615543404590.5803393868936.16315003699-11.70872884317.9068090397
203.8752336369-0.262645789393-1.156502230772.745695271610.3727847209763.60218236856-0.1056110877380.254088264925-0.2670613884840.02230099543660.176429805812-0.162507268037-0.3337160831960.119878071556-0.01186347821010.288820105058-0.02108165078490.006971012074720.392754494618-0.07117173737290.330710313293-3.12448295504-7.5862863637925.0810460975
213.81166782996-2.408318317960.9780847416596.66725583629-2.056884876775.416413625550.2311340243250.875871396878-0.78220087991-0.1337817784-0.07302484039060.694921383231-0.512841644039-0.135294497365-0.1925354462720.406687551936-0.120849923770.02254391002870.733119899519-0.1421094131130.547880522782-8.12097266057-10.693580956917.3763330599
224.268653366230.35779153334-0.9179899295394.14273143007-0.3625475840855.07379972542-0.3839152109670.464683997644-0.732920147462-0.2788993201060.0520929091265-0.493707230261-0.0597034305244-0.1378662127530.1647069147740.29222042303-0.04254981418960.03177618619680.530472787484-0.1563991981040.423721364491-0.459902705274-13.118311611618.3059064684
234.65036518567-1.81780317549-6.050070770981.694682956990.5617823650566.16275393462-0.1832803550720.131004499808-0.380827909978-0.22173594030.0005577073451640.0239446908379-0.2256137962620.0971779298170.1566430345810.337981929951-0.103853692170.009897015498750.441844594437-0.155475216280.3770560865743.89436026243-4.2922522758320.4511862808
245.00976231044-3.65067923635-1.13121455575.205684772831.561167886492.49809787415-0.2616462280410.3561034733251.52500403102-0.6365296658980.560124845424-1.83987600909-0.6858760289491.22217251127-0.1332526731440.80800006984-0.2095346325630.03157200805680.6665834778690.04941330561160.93043213283835.74592316948.5414621955-1.68442445076
252.401441334640.753665521589-1.335051131533.75441871017-2.70510496092.158436252610.173447946522-0.398201933431-0.0762153707290.645468407267-0.256815025806-0.4263696041430.009372492783080.05848014568190.1174140567940.746670535392-0.0950786731810.03269692728740.389395074887-0.06230651649610.48207729517226.5142897914-0.7918338383165.91673795235
267.751260930982.991356991350.7929316322515.771461780540.7633126008481.531627319120.275458409032-0.4118895052770.04649714771640.573682227583-0.470105694034-0.112943474001-0.1270636530620.01103974704060.2306472865740.752334940305-0.1320451818070.01675644500360.460423052164-0.09536619025070.50626366573325.71842015614.482974813795.85319197834
273.483843305383.147763572360.1755396658233.524288999530.3783055109316.436861204340.712635632769-0.747475795014-1.263240252021.45028310431-0.792095095654-1.370372850630.3517449768720.683657269638-0.02863455155270.6066612910150.0224007693764-0.03344129737560.434867292828-0.009852943505940.7616919554533.8240745531-2.357886830527.19811862408
285.429640629435.65860197159-3.332806382896.06184403897-3.365770423185.47757596842-0.944426635286-0.489362968259-1.14149096958-2.03207544779-0.31593352459-1.893955899361.198352242951.348541386261.193948968180.8795205442120.1193924891040.1802557037560.7089867896510.1581749577550.82567278805135.1518295333-3.122577729631.37832874524
293.30270524253-1.73007376623-1.985669432645.78535714122-2.716754966557.94275017282-0.04012062415491.208169556851.49610430709-0.5645659217350.7768980184980.215299854327-0.534562194041-0.00583252884683-0.6226650943540.7713215865350.01813706311310.1511728163230.4706091241810.02975492120620.577909530307-1.6077477818318.2501562420.0485945419
305.075135330980.398856688158-1.631891675765.21979218294-0.08223999214893.165184147260.0905719464337-0.09785793671270.726786559580.04498448972560.255686285768-0.295801203787-0.5702036046470.201006999046-0.3528110089720.4859489026370.003163581651140.06120075051520.390876074924-0.078123288660.333577562754-2.5503344858311.38789581827.7764992867
315.36139949131.51619843273-4.290892527981.0567993342-2.232945710365.16038500014-0.342443853032-0.280666011110.314805585939-0.3344572790190.680096592197-0.891312096809-0.7764011839720.236120541416-0.3337298042330.769933693618-0.1345564094350.2197599531950.513166076801-0.2155643383120.7744273616278.5149442068617.334312264516.9071781616
326.150412242490.139065381893-0.3555353309734.755099041630.4020097596918.54451946590.320961640103-0.114033037950.6232945872910.29526449869-0.435001772790.4858123167020.0959332066251-0.1345607945310.1180471076260.524312560035-0.08011069877070.1069917185460.304805340161-0.09597376233370.57585118231723.75361586611.1532273814-2.51201370839
334.43979665021.28253743956-0.05363910286066.487073264581.075719495895.870198385220.137935301329-0.07261101101040.589252820775-0.115912858868-0.1110815290470.30648478217-0.410026370573-0.116481221889-0.007345004540260.5564481165550.03864107923320.01925315357960.35765629322-0.08870019350390.59312381240922.322542743313.5028181121-4.66941426944
347.915740545263.914471559160.4670749284647.077859690524.309379184615.55477100710.02855246957330.695820098045-0.651758005178-1.58262827275-0.1166596514640.262435704886-0.613670611835-0.1860507540490.1088116523090.4229083417110.0519129026467-0.04460733357920.5264437072370.005032852923350.302405532986-23.94404252-8.4482959578631.1785916173
Refinement TLS group

Refine-ID: X-RAY DIFFRACTION

IDRefine TLS-IDSelection detailsAuth asym-IDLabel asym-IDAuth seq-IDLabel seq-ID
11chain 'A' and (resid 2 through 28 )AA2 - 281 - 27
22chain 'A' and (resid 29 through 56 )AA29 - 5628 - 55
33chain 'A' and (resid 57 through 84 )AA57 - 8456 - 83
44chain 'A' and (resid 85 through 118 )AA85 - 11884 - 117
55chain 'A' and (resid 119 through 137 )AA119 - 137118 - 136
66chain 'A' and (resid 138 through 152 )AA138 - 152137 - 151
77chain 'A' and (resid 153 through 174 )AA153 - 174152 - 173
88chain 'A' and (resid 175 through 274 )AA175 - 274174 - 269
99chain 'B' and (resid 1 through 5 )BB1 - 51 - 6
1010chain 'B' and (resid 6 through 11 )BB6 - 117 - 12
1111chain 'B' and (resid 12 through 19 )BB12 - 1913 - 20
1212chain 'B' and (resid 20 through 30 )BB20 - 3021 - 31
1313chain 'B' and (resid 31 through 41 )BB31 - 4132 - 42
1414chain 'B' and (resid 42 through 51 )BB42 - 5143 - 52
1515chain 'B' and (resid 52 through 71 )BB52 - 7153 - 72
1616chain 'B' and (resid 72 through 77 )BB72 - 7773 - 78
1717chain 'B' and (resid 78 through 90 )BB78 - 9079 - 91
1818chain 'B' and (resid 91 through 99 )BB91 - 9992 - 100
1919chain 'H' and (resid 1 through 17 )HC1 - 171 - 17
2020chain 'H' and (resid 18 through 59 )HC18 - 5918 - 61
2121chain 'H' and (resid 60 through 72 )HC60 - 7262 - 74
2222chain 'H' and (resid 73 through 87 )HC73 - 8775 - 92
2323chain 'H' and (resid 88 through 119 )HC88 - 11993 - 127
2424chain 'H' and (resid 120 through 134 )HC120 - 134128 - 142
2525chain 'H' and (resid 135 through 157 )HC135 - 157143 - 165
2626chain 'H' and (resid 158 through 188 )HC158 - 188166 - 196
2727chain 'H' and (resid 189 through 203 )HC189 - 203197 - 211
2828chain 'H' and (resid 204 through 215 )HC204 - 215212 - 223
2929chain 'L' and (resid 1 through 24 )LD1 - 241 - 23
3030chain 'L' and (resid 25 through 95B)LD25 - 9524 - 99
3131chain 'L' and (resid 96 through 113 )LD96 - 113100 - 118
3232chain 'L' and (resid 114 through 150 )LD114 - 150119 - 155
3333chain 'L' and (resid 151 through 212 )LD151 - 212156 - 217
3434chain 'P' and (resid 1 through 9 )PE1 - 91 - 9

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