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- PDB-7rh2: IRF4 Transcription factor mutant -K59R -

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Basic information

Entry
Database: PDB / ID: 7rh2
TitleIRF4 Transcription factor mutant -K59R
Components
  • DNA (5'-D(*CP*AP*AP*CP*TP*GP*AP*AP*AP*CP*CP*GP*AP*GP*AP*AP*AP*GP*C)-3')
  • DNA (5'-D(*GP*CP*TP*TP*TP*CP*TP*CP*GP*GP*TP*TP*TP*CP*AP*GP*TP*TP*G)-3')
  • ICSAT transcription factor
KeywordsTRANSCRIPTION / IRF4 / Cancer / Homodimer complex / protein/DNA interaction / Transcription factor
Function / homology
Function and homology information


positive regulation of interleukin-13 production / positive regulation of interleukin-4 production / positive regulation of interleukin-10 production / immune system process / positive regulation of interleukin-2 production / DNA-binding transcription factor activity, RNA polymerase II-specific / RNA polymerase II cis-regulatory region sequence-specific DNA binding / DNA-binding transcription factor activity / regulation of DNA-templated transcription / positive regulation of DNA-templated transcription ...positive regulation of interleukin-13 production / positive regulation of interleukin-4 production / positive regulation of interleukin-10 production / immune system process / positive regulation of interleukin-2 production / DNA-binding transcription factor activity, RNA polymerase II-specific / RNA polymerase II cis-regulatory region sequence-specific DNA binding / DNA-binding transcription factor activity / regulation of DNA-templated transcription / positive regulation of DNA-templated transcription / positive regulation of transcription by RNA polymerase II / nucleus
Similarity search - Function
Interferon regulatory factor-3 / Interferon-regulatory factor 3 / Interferon-regulatory factor 3 / Interferon regulatory factor, conserved site / IRF tryptophan pentad repeat DNA-binding domain signature. / Interferon regulatory factor transcription factor / interferon regulatory factor / Interferon regulatory factor DNA-binding domain / IRF tryptophan pentad repeat DNA-binding domain profile. / SMAD-like domain superfamily ...Interferon regulatory factor-3 / Interferon-regulatory factor 3 / Interferon-regulatory factor 3 / Interferon regulatory factor, conserved site / IRF tryptophan pentad repeat DNA-binding domain signature. / Interferon regulatory factor transcription factor / interferon regulatory factor / Interferon regulatory factor DNA-binding domain / IRF tryptophan pentad repeat DNA-binding domain profile. / SMAD-like domain superfamily / SMAD/FHA domain superfamily / Winged helix DNA-binding domain superfamily / Winged helix-like DNA-binding domain superfamily
Similarity search - Domain/homology
DNA / DNA (> 10) / ICSAT transcription factor
Similarity search - Component
Biological speciesHomo sapiens (human)
MethodX-RAY DIFFRACTION / SYNCHROTRON / MOLECULAR REPLACEMENT / Resolution: 2.47 Å
AuthorsWilliams, S.J. / Sundararaj, S. / Casarotto, M.G.
Citation
Journal: Protein Sci. / Year: 2022
Title: The molecular basis for the development of adult T-cell leukemia/lymphoma in patients with an IRF4 K59R mutation.
Authors: Sundararaj, S. / Seneviratne, S. / Williams, S.J. / Enders, A. / Casarotto, M.G.
#1: Journal: Nucleic Acids Res / Year: 2021
Title: Structural determinants of the IRF4/DNA homodimeric complex
Authors: Sundararaj, S. / Seneviratne, S. / Williams, S.J. / Enders, A. / Casarotto, M.G.
History
DepositionJul 16, 2021Deposition site: RCSB / Processing site: RCSB
Revision 1.0May 25, 2022Provider: repository / Type: Initial release
Revision 1.1Oct 18, 2023Group: Data collection / Refinement description
Category: chem_comp_atom / chem_comp_bond / pdbx_initial_refinement_model

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Structure visualization

Structure viewerMolecule:
MolmilJmol/JSmol

Downloads & links

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Assembly

Deposited unit
A: ICSAT transcription factor
B: ICSAT transcription factor
C: DNA (5'-D(*CP*AP*AP*CP*TP*GP*AP*AP*AP*CP*CP*GP*AP*GP*AP*AP*AP*GP*C)-3')
D: DNA (5'-D(*CP*AP*AP*CP*TP*GP*AP*AP*AP*CP*CP*GP*AP*GP*AP*AP*AP*GP*C)-3')
E: DNA (5'-D(*GP*CP*TP*TP*TP*CP*TP*CP*GP*GP*TP*TP*TP*CP*AP*GP*TP*TP*G)-3')
F: DNA (5'-D(*GP*CP*TP*TP*TP*CP*TP*CP*GP*GP*TP*TP*TP*CP*AP*GP*TP*TP*G)-3')
G: ICSAT transcription factor
H: ICSAT transcription factor


Theoretical massNumber of molelcules
Total (without water)75,8308
Polymers75,8308
Non-polymers00
Water23413
1
A: ICSAT transcription factor
B: ICSAT transcription factor
D: DNA (5'-D(*CP*AP*AP*CP*TP*GP*AP*AP*AP*CP*CP*GP*AP*GP*AP*AP*AP*GP*C)-3')
E: DNA (5'-D(*GP*CP*TP*TP*TP*CP*TP*CP*GP*GP*TP*TP*TP*CP*AP*GP*TP*TP*G)-3')


Theoretical massNumber of molelcules
Total (without water)37,9154
Polymers37,9154
Non-polymers00
Water543
TypeNameSymmetry operationNumber
identity operation1_555x,y,z1
2
C: DNA (5'-D(*CP*AP*AP*CP*TP*GP*AP*AP*AP*CP*CP*GP*AP*GP*AP*AP*AP*GP*C)-3')
F: DNA (5'-D(*GP*CP*TP*TP*TP*CP*TP*CP*GP*GP*TP*TP*TP*CP*AP*GP*TP*TP*G)-3')
G: ICSAT transcription factor
H: ICSAT transcription factor


Theoretical massNumber of molelcules
Total (without water)37,9154
Polymers37,9154
Non-polymers00
Water362
TypeNameSymmetry operationNumber
identity operation1_555x,y,z1
Unit cell
Length a, b, c (Å)114.874, 114.874, 154.788
Angle α, β, γ (deg.)90.000, 90.000, 120.000
Int Tables number152
Space group name H-MP3121
Space group name HallP312"
Symmetry operation#1: x,y,z
#2: -y,x-y,z+1/3
#3: -x+y,-x,z+2/3
#4: x-y,-y,-z+2/3
#5: -x,-x+y,-z+1/3
#6: y,x,-z
Noncrystallographic symmetry (NCS)NCS domain:
IDEns-IDDetails
d_1ens_1chain "A"
d_2ens_1(chain "B" and resid 22 through 129)
d_3ens_1(chain "G" and resid 22 through 129)
d_4ens_1(chain "H" and resid 22 through 129)
d_1ens_2chain "C"
d_2ens_2(chain "D" and ((resid 1 and (name O5" or name...
d_1ens_3(chain "E" and resid 2 through 19)
d_2ens_3chain "F"

NCS domain segments:
Dom-IDComponent-IDEns-IDBeg label comp-IDEnd label comp-IDLabel asym-IDLabel seq-ID
d_11ens_1GLYPROA1 - 108
d_21ens_1GLYPROB2 - 109
d_31ens_1GLYPROG2 - 109
d_41ens_1GLYPROH2 - 109
d_11ens_2DCDCC
d_21ens_2DCDCD
d_11ens_3DCDGE
d_21ens_3DCDGF

NCS ensembles :
ID
ens_1
ens_2
ens_3

NCS oper:
IDCodeMatrixVector
1given(0.914694951883, 0.312828226006, -0.25587427775), (0.184803635247, -0.886811953901, -0.423570743582), (-0.359417252507, 0.340151524225, -0.868974210876)-17.1293888222, -78.6863499542, -44.7641555081
2given(-0.930817389297, -0.127619917636, 0.342479407272), (-0.00512373920554, 0.9415200807, 0.336917920175), (-0.365448676396, 0.311854283698, -0.877037154663)61.1645517177, 9.43469142215, -44.7877528349
3given(-0.979937343872, -0.197498287239, -0.0267811243849), (0.197078604934, -0.980231085412, 0.0175226330411), (-0.0297123806379, 0.0118930958476, 0.999487733145)27.2970686867, -62.5965716806, 2.7460917285
4given(-0.977626776703, 0.20934153049, -0.0205428597003), (-0.209550728272, -0.977759971077, 0.00859832770426), (-0.0182859988252, 0.0127107266095, 0.999751999086)40.3187862349, -56.6400922293, -0.649998000519
5given(-0.980670783371, -0.194544756257, 0.0209081911129), (0.193944141858, -0.980621162392, -0.0277093072461), (0.0258937150969, -0.0231186868605, 0.999397339318)29.8903709243, -64.6830564494, -1.32819292307

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Components

#1: Protein
ICSAT transcription factor


Mass: 13132.837 Da / Num. of mol.: 4 / Mutation: K59R
Source method: isolated from a genetically manipulated source
Source: (gene. exp.) Homo sapiens (human) / Production host: Escherichia coli BL21 (bacteria) / References: UniProt: Q99419
#2: DNA chain DNA (5'-D(*CP*AP*AP*CP*TP*GP*AP*AP*AP*CP*CP*GP*AP*GP*AP*AP*AP*GP*C)-3')


Mass: 5840.830 Da / Num. of mol.: 2 / Source method: obtained synthetically / Source: (synth.) Homo sapiens (human)
#3: DNA chain DNA (5'-D(*GP*CP*TP*TP*TP*CP*TP*CP*GP*GP*TP*TP*TP*CP*AP*GP*TP*TP*G)-3')


Mass: 5808.741 Da / Num. of mol.: 2 / Source method: obtained synthetically / Source: (synth.) Homo sapiens (human)
#4: Water ChemComp-HOH / water


Mass: 18.015 Da / Num. of mol.: 13 / 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: 3.89 Å3/Da / Density % sol: 68.36 %
Crystal growTemperature: 291 K / Method: vapor diffusion, hanging drop / Details: 3-9 % PEG 4000, 0.1M Na acetate pH 4.8

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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: ADSC QUANTUM 210 / Detector: CCD / Date: Feb 10, 2021
RadiationProtocol: SINGLE WAVELENGTH / Monochromatic (M) / Laue (L): M / Scattering type: x-ray
Radiation wavelengthWavelength: 0.9537 Å / Relative weight: 1
ReflectionResolution: 2.47→47.36 Å / Num. obs: 42630 / % possible obs: 99.8 % / Redundancy: 10.2 % / Biso Wilson estimate: 59.8 Å2 / CC1/2: 0.998 / Rmerge(I) obs: 0.072 / Rpim(I) all: 0.033 / Rrim(I) all: 0.07493 / Χ2: 0.53 / Net I/σ(I): 15.4
Reflection shellResolution: 2.47→2.57 Å / Redundancy: 10.2 % / Rmerge(I) obs: 0.85 / Mean I/σ(I) obs: 1.7 / Num. unique obs: 4323 / CC1/2: 0.832 / Rpim(I) all: 0.38 / % possible all: 97.5

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Processing

Software
NameVersionClassification
PHENIX1.19.1_4122refinement
PHENIX1.19.1_4122refinement
XDSdata reduction
Aimlessdata scaling
PHASERphasing
RefinementMethod to determine structure: MOLECULAR REPLACEMENT
Starting model: 7JM4

7jm4


Resolution: 2.47→46.12 Å / SU ML: 0.3629 / Cross valid method: FREE R-VALUE / σ(F): 1.38 / Phase error: 26.099
Stereochemistry target values: GeoStd + Monomer Library + CDL v1.2
RfactorNum. reflection% reflection
Rfree0.2405 2001 4.7 %
Rwork0.2034 40579 -
obs0.2052 42580 99.7 %
Solvent computationShrinkage radii: 0.9 Å / VDW probe radii: 1.11 Å / Solvent model: FLAT BULK SOLVENT MODEL
Displacement parametersBiso mean: 64.87 Å2
Refinement stepCycle: LAST / Resolution: 2.47→46.12 Å
ProteinNucleic acidLigandSolventTotal
Num. atoms3668 1528 0 13 5209
Refine LS restraints
Refine-IDTypeDev idealNumber
X-RAY DIFFRACTIONf_bond_d0.01115483
X-RAY DIFFRACTIONf_angle_d1.28647725
X-RAY DIFFRACTIONf_chiral_restr0.0596796
X-RAY DIFFRACTIONf_plane_restr0.0318737
X-RAY DIFFRACTIONf_dihedral_angle_d26.61541216
Refine LS restraints NCS
Ens-IDDom-IDAuth asym-IDRefine-IDTypeRms dev position (Å)
ens_1d_2AX-RAY DIFFRACTIONTorsion NCS2.71052610992
ens_1d_3AX-RAY DIFFRACTIONTorsion NCS2.72278354424
ens_1d_4AX-RAY DIFFRACTIONTorsion NCS0.898205237038
ens_2d_2CX-RAY DIFFRACTIONTorsion NCS1.36870786032
ens_3d_2EX-RAY DIFFRACTIONTorsion NCS2.3551424805
LS refinement shell
Resolution (Å)Rfactor RfreeNum. reflection RfreeRfactor RworkNum. reflection RworkRefine-ID% reflection obs (%)
2.47-2.540.35231370.29522760X-RAY DIFFRACTION96.31
2.54-2.60.33091400.26422878X-RAY DIFFRACTION100
2.6-2.680.30691390.27872872X-RAY DIFFRACTION100
2.68-2.770.37421400.30422853X-RAY DIFFRACTION100
2.77-2.870.34381390.3012893X-RAY DIFFRACTION100
2.87-2.980.35651430.26672860X-RAY DIFFRACTION100
2.98-3.120.2691470.25882904X-RAY DIFFRACTION100
3.12-3.280.26941420.22462872X-RAY DIFFRACTION99.93
3.28-3.490.32041450.22342889X-RAY DIFFRACTION100
3.49-3.760.22291400.20312911X-RAY DIFFRACTION100
3.76-4.130.19391440.19012924X-RAY DIFFRACTION100
4.13-4.730.18751440.17072919X-RAY DIFFRACTION100
4.73-5.960.21791480.16812962X-RAY DIFFRACTION99.97
5.96-46.120.19721530.15973082X-RAY DIFFRACTION99.69
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)
14.01263791058-0.6041481493660.9491589318833.54636020738-1.331365517842.599743160670.02380290249710.18653963172-0.32107697697-0.496985181691-0.265691004179-0.3908399636760.8472755314130.7610450239320.3078009114820.6570361813660.1445606572140.2420678784850.673574470242-0.01975687134020.70371301906556.1262504458-40.168232402-60.3325582524
27.06460636275-0.426714520494-5.097413644166.41855900215-0.3281522515116.74688526877-0.736892589902-0.371622405232-0.3819737376080.2954773131920.1755143411320.00729394462331.34166740069-0.09559324475590.4269911948820.6365600242140.01619862692450.1161709005770.455770850781-0.02559799892030.79661588531343.2598450436-40.4874796461-44.9028201502
35.799750981511.56868544588-1.528340263115.77789145506-1.041360672867.060588678930.02157212002240.079271793906-0.0810106519085-0.0134392647641-0.472311675064-1.290492155430.7552593955421.300219866720.4167053498350.5812322146070.1763803623750.1057041170470.5231404939330.1588068055940.69469129912459.0029625379-42.7041857271-41.4478382605
42.17534479217-0.9228418756111.455384874623.04840734612-0.6883789036214.13460423951-0.1895460203830.2937781775320.0216002945854-0.24135425267-0.180598809152-0.252740373818-0.005213085886170.2646887794650.3190918407530.4290238469910.06660068195210.140328821520.4762868617890.03973934307430.58577305338951.5166988486-31.5751761644-54.6697392119
56.49743301078-3.65692404977-1.643890338062.406576710262.093853445466.713534744350.205205403758-0.008851991112260.306324001463-0.357255416442-0.00793441957175-0.938257859504-0.3167877251160.299934718833-0.2523038337450.471948821053-0.07892673923360.003366539899530.380338472630.0222639599960.5506814372542.1039171244-7.6924637037-31.3993820921
67.07287606971-0.09614491010042.512897165444.878929274850.3246290071176.360426224420.217786373147-0.465013692108-0.6977347170640.326500283728-0.117856055901-0.100463391720.23281416106-0.338561773721-0.11416414890.4790412685930.0444202844148-0.04320305629950.381844106137-0.02714797243880.45962329691634.0080364936-7.02673355645-23.2191162968
77.31832355943-0.8808858262952.772946199428.44851217105-3.298389193472.20784335028-0.651534406157-0.7574778986480.40008178868-0.192145554360.576595444330.9436256858860.248876995616-1.574921746210.1275597136720.5195191374250.0004499390781220.06416672062620.6635268033740.007481006080560.49841222367721.3203824834-14.4687738599-34.4641965715
80.637012290517-1.30973463569-0.1776237835823.09880411766-0.6456752387132.81742253152-0.100803461799-0.147393194032-0.07300519832550.09800983700910.0341711552354-0.1581171452540.176774603614-0.07610140834390.06292243588840.35771515361-0.03433274462370.02403905863480.335775295870.0009215813946560.46044783968935.9012589754-16.1029871571-38.6499498662
96.72167258939-0.5012959089570.6557120775977.1501403516-0.01912054612748.89731352942-0.254213711453-0.84179499644-0.2770309699070.8660293122590.006777166548170.2274408595470.678150827449-0.613807956510.1118378836110.6387361544650.004654965971650.05119956067350.473777442033-0.01671893243340.40650814549331.0244886863-17.1316118384-20.8143345351
103.92229345167-0.0137577303213.954031857131.54876935782-1.68953932835.86507472627-0.24115975302-0.475238037619-0.1334262656420.1454145749330.203812392365-0.202238674036-0.7670150906770.2755452002080.002515312369950.49462911583-0.114432927505-0.05106700169280.535227552953-0.06183889342970.4721680037322.16750147063-28.4100373939-35.4859317983
112.230312269832.12681723992-1.40643326032.24947692668-0.3410225006363.31208786615-0.4383444361590.166891336254-0.4661531290430.1472865382340.4408045389590.678328366343-0.242073247325-1.10252580357-0.0148030879310.4879661048030.06199464105270.1221152016520.8395702131640.009866389522310.805273699833-27.2954540597-27.803905715-42.0904798137
128.36466504714-3.336434445341.031127542558.30893069553-3.7266789556.56706952191-0.2462319914720.663711907169-1.47998004393-1.062013270520.1949797619490.2210728147520.497942840484-0.3876718723210.1351668820470.448816912674-0.1057607160140.08114291830220.555537818239-0.02837792677690.56759412988524.7289261759-27.5636060215-38.623976862
133.75444823193-0.1858828810620.4541209190571.943254225541.255703888782.21483592671-0.610796726414-0.1514251433650.243429407905-0.2043997727080.210596883762-0.5930193865020.1859901435910.7994816184950.3288229774970.3044295783240.05746020174580.01147507422680.5312590807760.1045849215310.6390850962254.3471064767-26.8192063218-39.8822039708
140.566651196922-0.509795884812-0.2639368363551.765338130431.917602636132.24487904238-0.6994615511470.3967207061580.673207369159-0.278284545622-0.185012571038-0.4911026063570.05866917015980.5377121650320.2184804959390.4205215930580.0333725478333-0.003026687487730.9240431117940.374119386591.0416995738467.8738907272-27.1390402897-48.9710500872
152.16019090084-0.125390909237-0.768001911911.25083516015-0.365425205681.98123023211-0.120338046108-0.407168441662-0.1155382967780.153522510932-0.0154600638827-0.2440687855530.3042463838020.2586709777260.1549849409990.3569370681820.03002775897910.07284404274060.4611296917810.04012011822420.52297680113145.5008062725-26.3668036682-38.2124277647
165.37423805429-0.6311877247060.5911228051677.058750885860.87735281515.7214565457-0.663489049048-0.740562622497-1.020969094311.150315704290.0483316108270.3331593301860.22179703589-0.3403905966510.7131993868620.548327067383-0.07455258493110.1801673512480.5048928671190.02961135139160.67086743407925.4796786352-33.0507661357-31.8675434764
174.385286080260.5442221320740.6472991502593.65077600576-1.864780282955.06847582485-0.1018642945720.121053868611-0.687111112903-0.05504799143920.4534529893240.07581976310560.0879373578444-0.214116040399-0.336954449070.4649807080250.103951153390.1187041636740.839604422717-0.003630809407270.846636135168-29.973959377-23.3071295867-46.0568321418
185.89363929516-0.193648398729-0.7688932979623.28500748285-0.1751822134063.00281926329-0.295104715952-0.345562932343-0.2531895176160.2988975777380.0734320470965-0.278005220192-0.34892758568-0.07655362242120.2328848663670.453119360991-0.0287995815742-0.02259797079670.527404001410.008229671906140.427283349023-7.66039121059-28.5265517193-37.0462303267
195.911140038631.44033434822-1.720123041186.73954204785-2.304458142052.02407605951-0.8446944201210.4264995689560.3205968022660.867925131097-0.630587427403-0.641163407729-0.4016449760581.562103667391.287594517230.673012093555-0.0591723027538-0.1097696644870.8787013259340.03645459810830.59490980265513.7648469086-28.4677950477-31.0140695091
206.46899948968-3.018870082283.098392786656.14712007651-1.820504583984.914430334890.20479861878-0.330908243257-1.168596325250.2554220356920.2199773690420.5529648059230.624077908146-0.390899430244-0.4096243163290.559664974171-0.137877202940.09765321920510.4800042861170.05058021621050.550379066392-11.7909182582-47.1945018791-30.19327721
214.65547691196-0.9231999214650.6463084999555.463960027332.004848573147.123079342010.25549515927-0.2910711992970.06567683814151.61796336964-0.00102628637230.5913423768550.858355187627-0.450157906284-0.3347283204830.892301886804-0.1091097262790.1449388415130.4718570436980.1167901444390.768846366724-4.60788687358-51.367055275-22.1836867342
221.67520629686-0.2182517378342.263169986722.54952186625-0.04799839339753.09592865986-0.0515408000676-1.15227534733-0.5500537505140.8688116554990.323803874907-0.002922134467320.1831050222970.339035781618-0.4557437618471.05593885281-0.0911203825621-0.04919695684150.692820919590.1156174024390.671733713547-1.1468975834-45.478597831-22.1185668947
232.15204156418-0.4434240637750.5588387461436.382909316334.035499841427.5339154926-0.132000750734-0.1860725730640.08359646500750.8714606939450.0654335395555-1.453246660450.5935282176671.34971982473-0.012906728760.5736657251780.0357541881357-0.1136523502080.7150854913320.05201058823150.73863858470210.3707488309-45.4734297563-33.2680273269
241.26762243642-0.1152109805351.177956427523.710073062772.427187691713.27735984340.0495905796806-0.129105916190.1499519086610.0503937472739-0.1724753330690.105416192193-0.116854815170.2440887564230.07203583267430.470198043686-0.09500566744330.005487786486580.4489745602970.04852718977640.50358801017-2.49965469853-41.576299859-39.9571423815
257.59741563779-3.684069459041.712804062585.22187426922-0.2673309618486.67102164006-0.357548027261-1.094648597020.2039924264191.14809018340.227266035994-0.419650032761-0.1828436983420.6728002141520.2794369911410.96630134824-0.112143156791-0.03985915051630.7484831469960.06956914948140.618318287727-1.34042870086-39.3647697746-20.8839392947
264.81175671846-3.50953127107-1.306126267032.80127508511-0.1006788524367.260720370180.5376938701370.2991276164480.585114938341-0.246910386648-0.1825320782370.673941632758-0.630131211079-1.01831287288-0.2417357400920.5950337938210.141463351879-0.07926231446810.52733012035-0.002303766624420.713413680221-24.560671659-12.4159800076-56.6036441719
274.665691764370.322859306271-0.6256896936214.552317511553.924915060377.414007527460.1822425232430.2558403996590.419358537658-0.707235453614-0.1782707395190.406467772141-0.797948862323-0.7345600145220.07055141464080.5307513625440.0801660098869-0.0640162287220.4849225207360.09686633615620.60905652663-14.4606603465-14.0070793135-61.8018705347
289.11844255653-1.951139912482.199497444183.92852041951-3.503824037743.80543237105-0.190490349869-0.6195258427210.8488936579030.8439250229360.146541155328-0.448910718183-1.365947099660.3113228592080.1831398692060.821470554787-0.0387634077336-0.0400385137510.426231617721-0.05473285026360.717641308906-5.97148857494-15.3096863591-43.836550416
294.011509874721.694866318440.8775367197313.092628872-0.9539960496153.66947302120.306776574155-0.1566882998030.0987481160910.61521778847-0.1520286919940.600892127171-1.1840952794-0.486260115814-0.198969630130.8263145206940.1160665038670.1041083773910.523016849674-0.0966553398120.62954614047-20.8604681834-9.72147128989-41.0567256589
303.08037250508-0.539782408427-1.091111247832.88955039902-0.2669617683673.68684153620.06398944393030.05850002875430.160132834670.105859813304-0.01602432077760.228375087477-0.141089675916-0.0231263968260.03589003164170.5015244446490.0273713365679-0.02060071729460.392973659172-0.03331077243840.50185803353-15.0518249643-22.5837836224-51.9545397668
313.176687123561.26271542484-2.916974466345.380806510410.2844950112143.139455440810.4391819639110.2447576162990.0247332888049-0.606452084183-0.1117569435450.617197124005-0.785077887328-0.777995068547-0.2296036082580.5382880519470.118810463098-0.004766855943550.611687548901-0.006039578686860.694104940245-17.1733021811-22.269373803-60.2466352393
Refinement TLS group

Refine-ID: X-RAY DIFFRACTION

IDRefine TLS-IDSelection detailsAuth asym-IDLabel asym-IDAuth seq-IDLabel seq-ID
11chain 'A' and (resid 22 through 53 )AA22 - 531 - 32
22chain 'A' and (resid 54 through 67 )AA54 - 6733 - 46
33chain 'A' and (resid 68 through 89 )AA68 - 8947 - 68
44chain 'A' and (resid 90 through 129 )AA90 - 12969 - 108
55chain 'B' and (resid 21 through 34 )BB21 - 341 - 14
66chain 'B' and (resid 35 through 53 )BB35 - 5315 - 33
77chain 'B' and (resid 54 through 68 )BB54 - 6834 - 48
88chain 'B' and (resid 69 through 109 )BB69 - 10949 - 89
99chain 'B' and (resid 110 through 129 )BB110 - 12990 - 109
1010chain 'C' and (resid 1 through 10 )CC1 - 10
1111chain 'C' and (resid 11 through 19 )CC11 - 19
1212chain 'D' and (resid 1 through 5 )DD1 - 5
1313chain 'D' and (resid 6 through 19 )DD6 - 19
1414chain 'E' and (resid 1 through 5 )EE1 - 5
1515chain 'E' and (resid 6 through 15 )EE6 - 15
1616chain 'E' and (resid 16 through 19 )EE16 - 19
1717chain 'F' and (resid 2 through 6 )FF2 - 6
1818chain 'F' and (resid 7 through 16 )FF7 - 16
1919chain 'F' and (resid 17 through 19 )FF17 - 19
2020chain 'G' and (resid 21 through 33 )GG21 - 331 - 13
2121chain 'G' and (resid 34 through 48 )GG34 - 4814 - 28
2222chain 'G' and (resid 49 through 53 )GG49 - 5329 - 33
2323chain 'G' and (resid 54 through 68 )GG54 - 6834 - 48
2424chain 'G' and (resid 69 through 103 )GG69 - 10349 - 83
2525chain 'G' and (resid 104 through 129 )GG104 - 12984 - 109
2626chain 'H' and (resid 21 through 34 )HH21 - 341 - 14
2727chain 'H' and (resid 35 through 53 )HH35 - 5315 - 33
2828chain 'H' and (resid 54 through 67 )HH54 - 6734 - 47
2929chain 'H' and (resid 68 through 89 )HH68 - 8948 - 69
3030chain 'H' and (resid 90 through 121 )HH90 - 12170 - 101
3131chain 'H' and (resid 122 through 129 )HH122 - 129102 - 109

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