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- PDB-8v2e: Crystal structure of B055 scaffold boost immunogen in complex wit... -

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Basic information

Entry
Database: PDB / ID: 8v2e
TitleCrystal structure of B055 scaffold boost immunogen in complex with a mature 10E8 Fab
Components
  • 10E8 EPITOPE SCAFFOLD B055
  • Antibody 10E8 FAB HEAVY CHAIN
  • Antibody 10E8 FAB LIGHT CHAIN
KeywordsIMMUNE SYSTEM / epitope-scaffold / boost immunogen / antigen-antibody complex
Biological speciesHomo sapiens (human)
synthetic construct (others)
MethodX-RAY DIFFRACTION / SYNCHROTRON / MOLECULAR REPLACEMENT / Resolution: 2.62 Å
AuthorsCho, S.Y. / Wilson, I.A.
Funding support United States, 2items
OrganizationGrant numberCountry
National Institutes of Health/National Institute Of Allergy and Infectious Diseases (NIH/NIAID) United States
International AIDS Vaccine Initiative United States
CitationJournal: Nat Immunol / Year: 2024
Title: Vaccination induces broadly neutralizing antibody precursors to HIV gp41.
Authors: Torben Schiffner / Ivy Phung / Rashmi Ray / Adriana Irimia / Ming Tian / Olivia Swanson / Jeong Hyun Lee / Chang-Chun D Lee / Ester Marina-Zárate / So Yeon Cho / Jiachen Huang / Gabriel ...Authors: Torben Schiffner / Ivy Phung / Rashmi Ray / Adriana Irimia / Ming Tian / Olivia Swanson / Jeong Hyun Lee / Chang-Chun D Lee / Ester Marina-Zárate / So Yeon Cho / Jiachen Huang / Gabriel Ozorowski / Patrick D Skog / Andreia M Serra / Kimmo Rantalainen / Joel D Allen / Sabyasachi Baboo / Oscar L Rodriguez / Sunny Himansu / Jianfu Zhou / Jonathan Hurtado / Claudia T Flynn / Katherine McKenney / Colin Havenar-Daughton / Swati Saha / Kaitlyn Shields / Steven Schultze / Melissa L Smith / Chi-Hui Liang / Laura Toy / Simone Pecetta / Ying-Cing Lin / Jordan R Willis / Fabian Sesterhenn / Daniel W Kulp / Xiaozhen Hu / Christopher A Cottrell / Xiaoya Zhou / Jennifer Ruiz / Xuesong Wang / Usha Nair / Kathrin H Kirsch / Hwei-Ling Cheng / Jillian Davis / Oleksandr Kalyuzhniy / Alessia Liguori / Jolene K Diedrich / Julia T Ngo / Vanessa Lewis / Nicole Phelps / Ryan D Tingle / Skye Spencer / Erik Georgeson / Yumiko Adachi / Michael Kubitz / Saman Eskandarzadeh / Marc A Elsliger / Rama R Amara / Elise Landais / Bryan Briney / Dennis R Burton / Diane G Carnathan / Guido Silvestri / Corey T Watson / John R Yates / James C Paulson / Max Crispin / Gevorg Grigoryan / Andrew B Ward / Devin Sok / Frederick W Alt / Ian A Wilson / Facundo D Batista / Shane Crotty / William R Schief /
Abstract: A key barrier to the development of vaccines that induce broadly neutralizing antibodies (bnAbs) against human immunodeficiency virus (HIV) and other viruses of high antigenic diversity is the design ...A key barrier to the development of vaccines that induce broadly neutralizing antibodies (bnAbs) against human immunodeficiency virus (HIV) and other viruses of high antigenic diversity is the design of priming immunogens that induce rare bnAb-precursor B cells. The high neutralization breadth of the HIV bnAb 10E8 makes elicitation of 10E8-class bnAbs desirable; however, the recessed epitope within gp41 makes envelope trimers poor priming immunogens and requires that 10E8-class bnAbs possess a long heavy chain complementarity determining region 3 (HCDR3) with a specific binding motif. We developed germline-targeting epitope scaffolds with affinity for 10E8-class precursors and engineered nanoparticles for multivalent display. Scaffolds exhibited epitope structural mimicry and bound bnAb-precursor human naive B cells in ex vivo screens, protein nanoparticles induced bnAb-precursor responses in stringent mouse models and rhesus macaques, and mRNA-encoded nanoparticles triggered similar responses in mice. Thus, germline-targeting epitope scaffold nanoparticles can elicit rare bnAb-precursor B cells with predefined binding specificities and HCDR3 features.
History
DepositionNov 22, 2023Deposition site: RCSB / Processing site: RCSB
Revision 1.0Jun 12, 2024Provider: repository / Type: Initial release

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Structure visualization

Structure viewerMolecule:
MolmilJmol/JSmol

Downloads & links

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Assembly

Deposited unit
A: Antibody 10E8 FAB HEAVY CHAIN
B: Antibody 10E8 FAB LIGHT CHAIN
C: 10E8 EPITOPE SCAFFOLD B055
D: Antibody 10E8 FAB HEAVY CHAIN
E: Antibody 10E8 FAB LIGHT CHAIN
F: 10E8 EPITOPE SCAFFOLD B055
hetero molecules


Theoretical massNumber of molelcules
Total (without water)140,1018
Polymers139,6586
Non-polymers4422
Water79344
1
A: Antibody 10E8 FAB HEAVY CHAIN
B: Antibody 10E8 FAB LIGHT CHAIN
C: 10E8 EPITOPE SCAFFOLD B055
hetero molecules


Theoretical massNumber of molelcules
Total (without water)70,0504
Polymers69,8293
Non-polymers2211
Water543
TypeNameSymmetry operationNumber
identity operation1_555x,y,z1
Buried area5050 Å2
ΔGint-35 kcal/mol
Surface area26050 Å2
MethodPISA
2
D: Antibody 10E8 FAB HEAVY CHAIN
E: Antibody 10E8 FAB LIGHT CHAIN
F: 10E8 EPITOPE SCAFFOLD B055
hetero molecules


Theoretical massNumber of molelcules
Total (without water)70,0504
Polymers69,8293
Non-polymers2211
Water543
TypeNameSymmetry operationNumber
identity operation1_555x,y,z1
Buried area4940 Å2
ΔGint-36 kcal/mol
Surface area25580 Å2
MethodPISA
Unit cell
Length a, b, c (Å)78.032, 84.941, 205.969
Angle α, β, γ (deg.)90.000, 90.000, 90.000
Int Tables number19
Space group name H-MP212121
Space group name HallP2ac2ab
Symmetry operation#1: x,y,z
#2: x+1/2,-y+1/2,-z
#3: -x,y+1/2,-z+1/2
#4: -x+1/2,-y,z+1/2

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Components

#1: Antibody Antibody 10E8 FAB HEAVY CHAIN


Mass: 25203.207 Da / Num. of mol.: 2
Source method: isolated from a genetically manipulated source
Source: (gene. exp.) Homo sapiens (human) / Production host: Homo sapiens (human)
#2: Antibody Antibody 10E8 FAB LIGHT CHAIN


Mass: 22989.459 Da / Num. of mol.: 2
Source method: isolated from a genetically manipulated source
Source: (gene. exp.) Homo sapiens (human) / Production host: Homo sapiens (human)
#3: Protein 10E8 EPITOPE SCAFFOLD B055


Mass: 21636.445 Da / Num. of mol.: 2
Source method: isolated from a genetically manipulated source
Source: (gene. exp.) synthetic construct (others) / Production host: Homo sapiens (human)
#4: 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.: 2 / Source method: obtained synthetically / Formula: C8H15NO6 / Feature type: SUBJECT OF INVESTIGATION
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
#5: Water ChemComp-HOH / water


Mass: 18.015 Da / Num. of mol.: 44 / Source method: isolated from a natural source / Formula: H2O
Has ligand of interestY

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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: 2.67 Å3/Da / Density % sol: 53.92 %
Crystal growTemperature: 293.15 K / Method: vapor diffusion, sitting drop / Details: PEG 3350, calcium chloride

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Data collection

DiffractionMean temperature: 100 K / Serial crystal experiment: N
Diffraction sourceSource: SYNCHROTRON / Site: SSRL / Beamline: BL12-2 / Wavelength: 0.97946 Å
DetectorType: DECTRIS PILATUS3 6M / Detector: PIXEL / Date: Aug 16, 2023
RadiationMonochromator: M / Protocol: SINGLE WAVELENGTH / Monochromatic (M) / Laue (L): M / Scattering type: x-ray
Radiation wavelengthWavelength: 0.97946 Å / Relative weight: 1
ReflectionResolution: 2.62→50 Å / Num. obs: 41203 / % possible obs: 99.7 % / Redundancy: 11 % / Biso Wilson estimate: 63.8 Å2 / CC1/2: 0.985 / Net I/σ(I): 20.6
Reflection shellResolution: 2.62→2.68 Å / Num. unique obs: 2057 / CC1/2: 0.502

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Processing

Software
NameVersionClassification
HKL-2000data collection
HKL-2000data scaling
PHASERphasing
Cootmodel building
PHENIXv1.2refinement
RefinementMethod to determine structure: MOLECULAR REPLACEMENT / Resolution: 2.62→44.03 Å / SU ML: 0.4384 / Cross valid method: FREE R-VALUE / σ(F): 1.35 / Phase error: 30.8568
Stereochemistry target values: GeoStd + Monomer Library + CDL v1.2
RfactorNum. reflection% reflection
Rfree0.2763 2101 5.07 %
Rwork0.2282 39312 -
obs0.2306 39313 99.12 %
Solvent computationShrinkage radii: 0.9 Å / VDW probe radii: 1.1 Å / Solvent model: FLAT BULK SOLVENT MODEL
Displacement parametersBiso mean: 85.16 Å2
Refinement stepCycle: LAST / Resolution: 2.62→44.03 Å
ProteinNucleic acidLigandSolventTotal
Num. atoms8227 0 28 44 8299
Refine LS restraints
Refine-IDTypeDev idealNumber
X-RAY DIFFRACTIONf_bond_d0.00668480
X-RAY DIFFRACTIONf_angle_d0.885911625
X-RAY DIFFRACTIONf_chiral_restr0.05241318
X-RAY DIFFRACTIONf_plane_restr0.00881508
X-RAY DIFFRACTIONf_dihedral_angle_d15.212772
LS refinement shell
Resolution (Å)Rfactor RfreeNum. reflection RfreeRfactor RworkNum. reflection RworkRefine-ID% reflection obs (%)
2.62-2.690.45981370.41652450X-RAY DIFFRACTION94.21
2.69-2.750.4571340.36462568X-RAY DIFFRACTION98.72
2.75-2.830.36021280.31692586X-RAY DIFFRACTION99.38
2.83-2.910.37041290.282588X-RAY DIFFRACTION99.34
2.91-30.3341350.27882617X-RAY DIFFRACTION99.67
3-3.110.29031280.27272624X-RAY DIFFRACTION99.67
3.11-3.240.32231520.29652597X-RAY DIFFRACTION99.67
3.24-3.380.34261410.25262613X-RAY DIFFRACTION99.75
3.38-3.560.26871410.22292626X-RAY DIFFRACTION99.71
3.56-3.780.24821450.22182594X-RAY DIFFRACTION99.56
3.78-4.080.24771440.21652653X-RAY DIFFRACTION99.68
4.08-4.490.25661510.18382629X-RAY DIFFRACTION99.5
4.49-5.130.24911720.17712608X-RAY DIFFRACTION98.76
5.13-6.460.23651460.21722716X-RAY DIFFRACTION99.76
6.47-44.030.25451180.21162843X-RAY DIFFRACTION99.3
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)
12.673034580620.452348132509-1.007445280383.7078660430.900264176466.13149305465-0.2892769673940.201581271832-0.209879086864-0.09268398945280.4592283490050.1596069160820.430906875583-0.829329074769-0.1508741672680.454946374406-0.1677738432730.06402215150980.5618376886680.09094619213080.462438888742-26.3373353256-14.339288979735.1202275328
29.50299017364.561676081785.004148503847.886071167281.482059332168.85526260372-0.0574147502729-0.591121296607-0.115035151906-0.0293748753156-0.143153201452-0.8131581606120.4751115873220.2446385270460.1622188461120.481891459698-0.04892213653610.01935054709250.80005418413-0.04625700217990.763035692273-14.7158400748-26.31227019513.99649528719
36.550816350443.68583657678-1.113320906623.01299394564-0.2299380894210.3580950015460.714957163972-0.863936691446-1.55767654820.243799787266-0.605020051946-0.874817161930.3526871866891.878686842020.3664495888540.4986456776510.1232278271640.00716108069641.290464598320.07121111468561.11843541897-9.52077858364-34.01923419980.260189506271
41.636550557270.925602238327-1.33608307082.25387844824-1.062380242968.164046104470.02041174240010.2628279523150.2098528838220.2204722415480.296460113567-0.0513021832979-0.491607049716-0.199807140754-0.3013491600610.339750878645-0.03693120345980.06763995275130.4928537278940.03293512234970.524252130007-14.9645488590.46881810767225.6112204045
56.689291133934.174764950871.298231740265.945406538013.275928182258.28821223682-0.7978033414790.70866010590.584482140908-1.850049792010.2338731322330.800848738255-1.23438057616-0.2998016163970.4279674399620.713895913116-0.0193572898105-0.1585764817990.774177481721-0.1206384418470.721993285656-17.0409208992-14.8963471245-3.56136304582
66.306969998126.26236727905-1.805117294199.41595349015-1.26328932227.731150907431.66280315113-2.37406095533-0.414175538191.62366204771-1.53699548071-0.0791667094639-0.5977106547310.119938349094-0.1368755119531.39367532697-0.160331696112-0.04372234953130.828764376374-0.1434425344340.674652500935-19.19745094581.0085774157670.9552161397
78.613027569657.74878315758-2.303503327679.51688024358-1.183387963325.470326457680.6109994048820.192623547632-1.257363012791.20101923196-0.380783138411-1.51655737621-0.6506463184860.438935932628-0.3303810543461.104025984370.102000776776-0.02419860775150.630929036778-0.01827781645930.733834658685-19.7535824623-5.431780938463.9482304402
84.823539420892.325484594150.6828769955734.31346497036-3.648575109515.38417160548-0.06335562875460.009086813015210.569828441825-1.44102353260.350479908882-1.15068690932-2.129080500630.0743678686467-0.3497116497421.5111727378-0.04104288690180.245778588180.570231535315-0.06014377004260.784390479006-15.606771629412.126311528957.7477786575
97.139887490764.763264683250.531901567818.60605447508-1.694889587362.81819799329-0.3564739385440.0399600540852-0.2412765616850.4848865107110.29326583071-0.0390736536721-0.205563591827-0.2352795623020.03029610988730.8980703365260.2042701547280.07761957824540.591598279759-0.007351879521920.546104467694-24.70660242660.047212710702861.9479078101
107.843476183264.890906873585.954267169994.891541125493.310177422164.61289793012-0.803880594881-0.1091912700540.09053872917870.395809606420.345733178693-0.534971633934-2.5679404933-0.08756355597550.3157630848381.25301415266-0.184294692313-0.01372070280850.752141694123-0.1001236943950.770937970598-10.425175860210.260980967258.7718886516
115.89468145911-1.043275210042.626928883018.220658832472.933488734967.36203301881-0.510919775110.003953070078290.6203251151420.6494149180830.469423347961-0.789982355563-1.724474395480.483493028036-0.1011125693120.9078939665330.03704024455790.109243757050.6066846128430.00336677984480.569810502197-21.77765423096.2564834208660.964361754
126.20190466994-0.6844547748973.261569803466.675580986333.489850054425.56478790024-0.723714180154-0.7595716442560.471055721934-0.5519925778790.196704299518-0.18452189728-2.26981213284-0.2232743857830.4085568707921.057470383870.221976168030.1971250080070.554766350070.04092938038710.369929308323-27.86615716347.9702937231652.3953480261
136.613652608030.613459840668-1.318890180880.06456953641210.03064223648923.421422922491.478046012780.1518753456190.2876325113811.88613781871-1.08824523144-0.251363434349-0.514609581981-0.500999339195-0.3648411225012.650015477150.3403254010040.03961709837610.770932974873-0.1288022080550.977251592772-24.445640181721.28258874165.0190228022
140.727099788483-0.441486600832-0.5598639014050.8294393194180.6143036730840.564015758068-0.03226173129950.0954315293584-0.1059244421020.033348842165-0.07809998228970.173817385723-0.16416979532-0.3497080264081.302025973371.547613291670.8275297870110.3699880707661.44154293205-0.05261706313010.880910877974-34.216286237813.358932212366.4015796451
154.67286241218-1.850735733942.064478266993.20694687434-0.8178334235088.84242139904-0.109557521320.308667350131-0.1255923901040.003326378457810.693697574206-0.083637936193-1.48427723087-0.897228797678-0.2156119111581.0813873420.3779476328810.1986919574580.8490128210570.08267546636140.525796663226-31.30957129466.93888313165.8535071041
163.892189937873.55132706577-4.222947519934.66193086625-2.463394169855.8583488925-0.4520566070290.08202883140511.51061856887-0.4903806245140.6407288020840.453910625267-0.9162485862460.699349498512-0.0681872046810.591222751609-0.2206836839970.0463439468480.790569068048-0.08415266629070.586554947734-50.190246267723.951509782227.8899223897
175.817351494441.733654838291.447569379446.472522926391.107482336194.39751832869-0.381678531373-0.265578922387-0.1112534700910.1910923678280.305945633802-0.119537919388-0.06186934992630.498617894319-0.09779521432020.314423816209-0.0985618728801-0.0132409188090.430998029632-0.006197249158820.402004001682-51.063415860315.364455198333.6737589103
182.046134238021.253954315730.05918407405665.67394654307-0.731513259516.4487251988-0.16897710623-0.1138116841830.03162253162790.2382688687960.253840979292-0.339361139458-0.02277009890530.7954056853290.004801965473440.3221768931540.00843988928637-0.03339559678270.542823839657-0.1213189889020.488670906917-48.5322385112.360709872235.5966973364
193.61000758278-0.696740833994-0.4390836612111.39273948378-1.04030022822.00751418358-0.7397983864941.603157894790.919622865741-0.1886845059290.5552771867290.829514689838-1.855489468590.4715219820080.03513241535061.18529266077-0.5051197945150.01662522020391.102194580210.465431305311.16986326154-50.154735952229.3086219604-0.704846578137
203.20523173844-0.205752342631-2.61864624496.72816697607-4.080969206987.070600685880.4267201632690.2857261929930.221497299764-0.6321656063240.2456575213180.699246082859-0.0622041951077-0.673417366884-0.4918655934540.824191452633-0.2380365409070.007785166103480.7426926423530.2365279032180.712413136945-55.735738903626.08271511311.63572660776
214.892801526880.7558996005782.194994348355.243134963872.572844495287.484537255870.405527462122-0.4953279490030.669588900888-0.4554612437780.5241323336620.124618285406-1.065986752570.364105577124-1.349951509151.0752642133-0.46197486637-0.1145306036541.36870452040.09959377587581.14463639443-56.01314239435.19055852733.22206741162
225.568554308773.912445271554.473979241026.905155537646.536038119047.764169978350.1157866915240.6584136047860.366401922868-1.053835214320.6969273587590.735260722347-0.378852470155-0.127362684717-0.294978378991.53224787388-0.307580474217-0.09586140785740.4724063051060.2428178979820.809620347535-56.852666719634.8687322818-6.86246562952
231.86197605708-2.011385692330.4697409522075.77533843249-2.709793267084.22006377985-0.5359911999891.266625930460.2518418553780.09535911372190.0969183161661-0.1070939495690.5693840209751.033773220310.3336604010390.3698164932710.099732436634-0.05763189254960.646177760154-0.1149414862770.535085401067-57.7021435978-3.2006008212917.2161702196
242.113781030781.542596439371.12791126594.182119624412.461442325629.259661253030.07364436486760.1648519639870.005481592815460.06802282685750.1913823617060.02677954897130.391085912434-0.00645211972838-0.03976241466950.2071150976370.0138907573020.02268489515440.3243399656910.0111732078680.384680938283-57.26849617680.49047737147526.6757385714
252.41570872871.324615353030.4297524438593.441635723041.249185752995.00855169054-0.06322919125510.06393919789580.0160052337656-0.04481576346490.04429858254020.2798350405760.681076719760.100969945001-0.06322653845580.3736117939570.01198061186790.007723754231340.492646387557-0.02675053904810.432109773842-60.0692161038-0.27522614281723.7725902958
260.319921811411-0.187262841892-0.4333138827110.1702902762310.09042335377621.37482480133-0.3833212366160.4856952192390.363379203435-1.262968494660.08720153802960.1239048718830.690682797920.1597343412370.05831451653221.77300345957-0.696625272185-0.05166232869741.381370266990.4069636202760.921444322487-50.54011412123.6100687916-10.3571156673
272.583229979771.090452539670.9742810071643.594059992330.6186810478133.63436649075-0.9486674028930.0352209485413-0.408263884986-2.155424112820.00128177140396-0.4748358910390.0493128667296-0.2027940888750.2149957491310.88518197567-0.1458105106930.1743274170320.9907541610660.2383566782060.812780213126-56.715133554311.6365988243-2.4780793833
288.069886979832.46938338187-1.319327542276.84232931044-0.2464133575268.35517431744-0.399339259975-0.9140961714970.4797341675460.09682835150980.0901492655167-0.1896448611350.15625490721-0.4635961102680.4538651115050.580559571637-0.1173804696980.01100702235430.716330071650.2815728665340.739123677432-57.180038327912.49042819122.5442213193
292.515441786360.243729148401-0.7765235666070.6490432000590.164205671464.09583425156-1.373831785651.04618876583-0.485568205787-2.144329130010.951870722052-0.8069835880830.8706888177990.4923196965830.6638229516861.50617220603-0.2620907328330.3503895434411.198255292650.2021734545631.02711360106-50.222845819612.9821131327-10.2969797695
307.718637368293.5229449507-1.464276480064.52100011372-1.818704088726.073251385020.88807660851-1.988798986220.4918583918741.7381385884-0.5358460844160.7598383649580.7795497473690.061717837626-0.3218953720091.607759499110.1309563906790.4034879841620.7089044065160.07793689629270.754753297751-61.3365721407-0.21754812145867.7290597471
319.13794180526.529419901192.572257860835.830624668892.404815644987.9191676423-0.4031830080680.6910820930741.287443352660.7407528024050.3426933584081.456257920220.250620230946-0.209311499438-0.05905811122831.502480170230.2219077422070.04880073624520.7964580068390.08989144003480.842504792532-59.84051516016.1886316832360.4593057825
322.692927649270.8512132589080.3146075420832.00002235428-3.055214290873.382476910280.6061876524360.1889416659340.367547757437-1.041316395220.5445719078891.007030060640.643444871652-0.246502288047-1.001097211131.952412937420.05422626953370.05795140670290.5763863183140.01463630563710.690104786469-63.5310627104-11.269678842753.5250409133
334.636120140224.904930787292.026913276276.08300110190.9180727440344.98161605503-0.07999507535440.3913494527680.3611939852270.2549145097630.1248334348760.6740837621871.07293418861-0.2329872099180.06287932586311.081301833670.191666145620.1524824786580.5650635689720.01288690271020.712742748422-58.5039545032-2.5885576556660.0004567855
340.7181752612461.52093711749-0.6487568203694.134711503580.2919401805855.56880824389-0.5694560236860.4243315586070.836126194633-0.6432420887250.5593733738371.58892714031.34298782678-0.538367369081-0.03548775162871.12414416224-0.1160666277750.0375169438590.5804670668280.2456684780781.1180781489-68.0817298484-8.3448943594848.7370296941
353.720027472351.79877227688-3.105522950586.11294518482-1.881358279147.19710919041-0.470448318809-0.143226488259-0.9616942739391.086618071890.0651291865364-0.3736563870871.381302943950.1644533392540.2850185744231.177022077070.3145893056320.04710406128970.610403487334-0.005359639926530.513301461966-53.0295116174-6.677242252253.6874528964
363.304715835723.049357726032.551614841589.247859871949.051485775349.96598056749-0.1166924280750.2533672377790.620573476325-0.194486371729-1.09398936531.568034645410.3802962612360.7490613406850.778474287942.199239373910.3133661470880.2012150142470.756059262932-0.01593035034661.04050132863-54.9487268177-20.956443397962.7843047721
372.2117063842-0.1620838013240.1864085945512.66112960279-2.159850856452.85623633197-0.01589574008750.022068222228-0.117129837411.132434636790.0593499604378-0.4478009392161.245358281621.041580042990.1410841707251.829344838790.723040807558-0.02784551590661.09734919371-0.1307829631860.563349569621-47.0257475848-8.9109053356364.6561178246
Refinement TLS group

Refine-ID: X-RAY DIFFRACTION

IDRefine TLS-IDSelection detailsAuth asym-IDLabel asym-IDAuth seq-IDLabel seq-ID
11chain 'A' and (resid 1 through 119 )AA1 - 1191 - 137
22chain 'A' and (resid 120 through 183 )AA120 - 183138 - 193
33chain 'A' and (resid 184 through 214 )AA184 - 214194 - 223
44chain 'B' and (resid 2 through 118 )BB2 - 1181 - 120
55chain 'B' and (resid 119 through 209 )BB119 - 209121 - 207
66chain 'C' and (resid 3 through 21 )CC3 - 211 - 19
77chain 'C' and (resid 22 through 38 )CC22 - 3820 - 36
88chain 'C' and (resid 39 through 51 )CC39 - 5137 - 49
99chain 'C' and (resid 52 through 70 )CC52 - 7050 - 68
1010chain 'C' and (resid 71 through 85 )CC71 - 8569 - 83
1111chain 'C' and (resid 86 through 98 )CC86 - 9884 - 96
1212chain 'C' and (resid 99 through 114 )CC99 - 11497 - 112
1313chain 'C' and (resid 115 through 126 )CC115 - 126113 - 124
1414chain 'C' and (resid 127 through 140 )CC127 - 140125 - 138
1515chain 'C' and (resid 141 through 158 )CC141 - 158139 - 156
1616chain 'D' and (resid 1 through 17 )DD1 - 171 - 17
1717chain 'D' and (resid 18 through 51 )DD18 - 5118 - 51
1818chain 'D' and (resid 52 through 111 )DD52 - 11152 - 129
1919chain 'D' and (resid 112 through 143 )DD112 - 143130 - 150
2020chain 'D' and (resid 144 through 193 )DD144 - 193151 - 191
2121chain 'D' and (resid 194 through 204 )DD194 - 204192 - 202
2222chain 'D' and (resid 205 through 214 )DD205 - 214203 - 212
2323chain 'E' and (resid 2 through 18 )EE2 - 181 - 16
2424chain 'E' and (resid 19 through 48 )EE19 - 4817 - 46
2525chain 'E' and (resid 49 through 113 )EE49 - 11347 - 115
2626chain 'E' and (resid 114 through 129 )EE114 - 129116 - 131
2727chain 'E' and (resid 130 through 148 )EE130 - 148132 - 150
2828chain 'E' and (resid 149 through 173 )EE149 - 173151 - 170
2929chain 'E' and (resid 174 through 208 )EE174 - 208171 - 205
3030chain 'F' and (resid 3 through 21 )FF3 - 211 - 19
3131chain 'F' and (resid 22 through 37 )FF22 - 3720 - 35
3232chain 'F' and (resid 38 through 51 )FF38 - 5136 - 49
3333chain 'F' and (resid 52 through 76 )FF52 - 7650 - 74
3434chain 'F' and (resid 77 through 85 )FF77 - 8575 - 83
3535chain 'F' and (resid 86 through 114 )FF86 - 11484 - 112
3636chain 'F' and (resid 115 through 126 )FF115 - 126113 - 124
3737chain 'F' and (resid 127 through 157 )FF127 - 157125 - 155

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