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- PDB-10xk: Bifidobacterium primatium DnaA DI -

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Basic information

Entry
Database: PDB / ID: 10xk
TitleBifidobacterium primatium DnaA DI
ComponentsChromosomal replication initiator protein DnaA
KeywordsDNA BINDING PROTEIN / Initiator
Function / homology
Function and homology information


regulation of DNA replication / DNA replication origin binding / DNA replication initiation / lipid binding / ATP binding / plasma membrane / cytoplasm
Similarity search - Function
Chromosomal replication control, initiator DnaA, conserved site / DnaA protein signature. / Chromosomal replication control, initiator DnaA / Chromosomal replication initiator, DnaA C-terminal / Bacterial dnaA protein helix-turn-helix / Bacterial dnaA protein helix-turn-helix domain / Chromosomal replication control, initiator DnaA-like / Chromosomal replication initiator protein DnaA / Bacterial DnaA ATPAse domain / Trp repressor/replication initiator ...Chromosomal replication control, initiator DnaA, conserved site / DnaA protein signature. / Chromosomal replication control, initiator DnaA / Chromosomal replication initiator, DnaA C-terminal / Bacterial dnaA protein helix-turn-helix / Bacterial dnaA protein helix-turn-helix domain / Chromosomal replication control, initiator DnaA-like / Chromosomal replication initiator protein DnaA / Bacterial DnaA ATPAse domain / Trp repressor/replication initiator / ATPases associated with a variety of cellular activities / AAA+ ATPase domain / P-loop containing nucleoside triphosphate hydrolase
Similarity search - Domain/homology
Chromosomal replication initiator protein DnaA
Similarity search - Component
Biological speciesBifidobacterium primatium (bacteria)
MethodX-RAY DIFFRACTION / MOLECULAR REPLACEMENT / Resolution: 2.4 Å
AuthorsEllis, P.K. / Schumacher, M.A.
Funding support United States, 2items
OrganizationGrant numberCountry
National Institutes of Health/National Institute of General Medical Sciences (NIH/NIGMS)R35GM130290 United States
National Science Foundation (NSF, United States)DGE 2139754 United States
CitationJournal: To Be Published
Title: Structures reveal DnaA domain I dimer conserved across Actinomycetes: implications for replication initiation
Authors: Ellis, P.K. / Schumacher, M.A.
History
DepositionFeb 11, 2026Deposition site: RCSB / Processing site: RCSB
Revision 1.0Jun 3, 2026Provider: repository / Type: Initial release

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Structure visualization

Structure viewerMolecule:
MolmilJmol/JSmol

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Assembly

Deposited unit
A: Chromosomal replication initiator protein DnaA
B: Chromosomal replication initiator protein DnaA
C: Chromosomal replication initiator protein DnaA
D: Chromosomal replication initiator protein DnaA
E: Chromosomal replication initiator protein DnaA
F: Chromosomal replication initiator protein DnaA
G: Chromosomal replication initiator protein DnaA
H: Chromosomal replication initiator protein DnaA


Theoretical massNumber of molelcules
Total (without water)78,1608
Polymers78,1608
Non-polymers00
Water6,485360
1
E: Chromosomal replication initiator protein DnaA

A: Chromosomal replication initiator protein DnaA


Theoretical massNumber of molelcules
Total (without water)19,5402
Polymers19,5402
Non-polymers00
Water362
TypeNameSymmetry operationNumber
identity operation1_555x,y,z1
crystal symmetry operation2_655-x+1,y+1/2,-z1
2
B: Chromosomal replication initiator protein DnaA
D: Chromosomal replication initiator protein DnaA


Theoretical massNumber of molelcules
Total (without water)19,5402
Polymers19,5402
Non-polymers00
Water362
TypeNameSymmetry operationNumber
identity operation1_555x,y,z1
3
C: Chromosomal replication initiator protein DnaA

F: Chromosomal replication initiator protein DnaA


Theoretical massNumber of molelcules
Total (without water)19,5402
Polymers19,5402
Non-polymers00
Water362
TypeNameSymmetry operationNumber
identity operation1_555x,y,z1
crystal symmetry operation1_455x-1,y,z1
4
G: Chromosomal replication initiator protein DnaA

H: Chromosomal replication initiator protein DnaA


Theoretical massNumber of molelcules
Total (without water)19,5402
Polymers19,5402
Non-polymers00
Water362
TypeNameSymmetry operationNumber
identity operation1_555x,y,z1
crystal symmetry operation1_656x+1,y,z+11
Unit cell
Length a, b, c (Å)55.927, 124.131, 63.747
Angle α, β, γ (deg.)90.000, 97.700, 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
Noncrystallographic symmetry (NCS)NCS domain:
IDEns-IDDetails (eV)
d_1ens_1(chain "A" and (resid 4 through 7 or (resid 8...
d_2ens_1(chain "B" and (resid 4 through 7 or (resid 8...
d_3ens_1(chain "C" and (resid 4 through 7 or (resid 8...
d_4ens_1(chain "D" and (resid 4 through 7 or (resid 8...
d_5ens_1(chain "E" and (resid 4 through 7 or (resid 8...
d_6ens_1(chain "F" and (resid 4 through 7 or (resid 8...
d_7ens_1(chain "G" and (resid 4 through 10 or resid 13...
d_8ens_1(chain "H" and (resid 4 through 7 or (resid 8...

NCS domain segments:

Ens-ID: ens_1

Dom-IDComponent-IDBeg auth comp-IDBeg label comp-IDEnd auth comp-IDEnd label comp-IDAuth asym-IDLabel asym-IDAuth seq-IDLabel seq-ID
d_11ALAALAALAALAAA4 - 107 - 13
d_12ILEILEALAALAAA13 - 1716 - 20
d_13ASPASPLEULEUAA19 - 2122 - 24
d_14THRTHRPROPROAA26 - 2929 - 32
d_15ASPASPASPASPAA3134
d_16SERSERVALVALAA33 - 3536 - 38
d_17ASPASPVALVALAA37 - 4340 - 46
d_18ASPASPSERSERAA45 - 4648 - 49
d_19ILEILEASNASNAA48 - 5451 - 57
d_110ILEILEASNASNAA56 - 6359 - 66
d_111ALAALALEULEUAA66 - 6869 - 71
d_112ALAALAGLYGLYAA70 - 7773 - 80
d_113PROPROILEILEAA79 - 8482 - 87
d_114ILEILEVALVALAA86 - 8789 - 90
d_21ALAALAALAALABB4 - 107 - 13
d_22ILEILEALAALABB13 - 1716 - 20
d_23ASPASPLEULEUBB19 - 2122 - 24
d_24THRTHRPROPROBB26 - 2929 - 32
d_25ASPASPASPASPBB3134
d_26SERSERVALVALBB33 - 3536 - 38
d_27ASPASPVALVALBB37 - 4340 - 46
d_28ASPASPSERSERBB45 - 4648 - 49
d_29ILEILEASNASNBB48 - 5451 - 57
d_210ILEILEASNASNBB56 - 6359 - 66
d_211ALAALALEULEUBB66 - 6869 - 71
d_212ALAALAGLYGLYBB70 - 7773 - 80
d_213PROPROILEILEBB79 - 8482 - 87
d_214ILEILEVALVALBB86 - 8789 - 90
d_31ALAALAALAALACC4 - 107 - 13
d_32ILEILEALAALACC13 - 1716 - 20
d_33ASPASPLEULEUCC19 - 2122 - 24
d_34THRTHRPROPROCC26 - 2929 - 32
d_35ASPASPASPASPCC3134
d_36SERSERVALVALCC33 - 3536 - 38
d_37ASPASPVALVALCC37 - 4340 - 46
d_38ASPASPSERSERCC45 - 4648 - 49
d_39ILEILEASNASNCC48 - 5451 - 57
d_310ILEILEASNASNCC56 - 6359 - 66
d_311ALAALALEULEUCC66 - 6869 - 71
d_312ALAALAGLYGLYCC70 - 7773 - 80
d_313PROPROILEILECC79 - 8482 - 87
d_314ILEILEVALVALCC86 - 8789 - 90
d_41ALAALAALAALADD4 - 107 - 13
d_42ILEILEALAALADD13 - 1716 - 20
d_43ASPASPLEULEUDD19 - 2122 - 24
d_44THRTHRPROPRODD26 - 2929 - 32
d_45ASPASPASPASPDD3134
d_46SERSERVALVALDD33 - 3536 - 38
d_47ASPASPVALVALDD37 - 4340 - 46
d_48ASPASPSERSERDD45 - 4648 - 49
d_49ILEILEASNASNDD48 - 5451 - 57
d_410ILEILEASNASNDD56 - 6359 - 66
d_411ALAALALEULEUDD66 - 6869 - 71
d_412ALAALAGLYGLYDD70 - 7773 - 80
d_413PROPROILEILEDD79 - 8482 - 87
d_414ILEILEVALVALDD86 - 8789 - 90
d_51ALAALAALAALAEE4 - 107 - 13
d_52ILEILEALAALAEE13 - 1716 - 20
d_53ASPASPLEULEUEE19 - 2122 - 24
d_54THRTHRPROPROEE26 - 2929 - 32
d_55ASPASPASPASPEE3134
d_56SERSERVALVALEE33 - 3536 - 38
d_57ASPASPVALVALEE37 - 4340 - 46
d_58ASPASPSERSEREE45 - 4648 - 49
d_59ILEILEASNASNEE48 - 5451 - 57
d_510ILEILEASNASNEE56 - 6359 - 66
d_511ALAALALEULEUEE66 - 6869 - 71
d_512ALAALAGLYGLYEE70 - 7773 - 80
d_513PROPROILEILEEE79 - 8482 - 87
d_514ILEILEVALVALEE86 - 8789 - 90
d_61ALAALAALAALAFF4 - 107 - 13
d_62ILEILEALAALAFF13 - 1716 - 20
d_63ASPASPLEULEUFF19 - 2122 - 24
d_64THRTHRPROPROFF26 - 2929 - 32
d_65ASPASPASPASPFF3134
d_66SERSERVALVALFF33 - 3536 - 38
d_67ASPASPVALVALFF37 - 4340 - 46
d_68ASPASPSERSERFF45 - 4648 - 49
d_69ILEILEASNASNFF48 - 5451 - 57
d_610ILEILEASNASNFF56 - 6359 - 66
d_611ALAALALEULEUFF66 - 6869 - 71
d_612ALAALAGLYGLYFF70 - 7773 - 80
d_613PROPROILEILEFF79 - 8482 - 87
d_614ILEILEVALVALFF86 - 8789 - 90
d_71ALAALAALAALAGG4 - 107 - 13
d_72ILEILEALAALAGG13 - 1716 - 20
d_73ASPASPLEULEUGG19 - 2122 - 24
d_74THRTHRPROPROGG26 - 2929 - 32
d_75ASPASPASPASPGG3134
d_76SERSERVALVALGG33 - 3536 - 38
d_77ASPASPVALVALGG37 - 4340 - 46
d_78ASPASPSERSERGG45 - 4648 - 49
d_79ILEILEASNASNGG48 - 5451 - 57
d_710ILEILEASNASNGG56 - 6359 - 66
d_711ALAALALEULEUGG66 - 6869 - 71
d_712ALAALAGLYGLYGG70 - 7773 - 80
d_713PROPROILEILEGG79 - 8482 - 87
d_714ILEILEVALVALGG86 - 8789 - 90
d_81ALAALAALAALAHH4 - 107 - 13
d_82ILEILEALAALAHH13 - 1716 - 20
d_83ASPASPLEULEUHH19 - 2122 - 24
d_84THRTHRPROPROHH26 - 2929 - 32
d_85ASPASPASPASPHH3134
d_86SERSERVALVALHH33 - 3536 - 38
d_87ASPASPVALVALHH37 - 4340 - 46
d_88ASPASPSERSERHH45 - 4648 - 49
d_89ILEILEASNASNHH48 - 5451 - 57
d_810ILEILEASNASNHH56 - 6359 - 66
d_811ALAALALEULEUHH66 - 6869 - 71
d_812ALAALAGLYGLYHH70 - 7773 - 80
d_813PROPROILEILEHH79 - 8482 - 87
d_814ILEILEVALVALHH86 - 8789 - 90

NCS oper:
IDCodeMatrixVector
1given(-0.494724213134, 0.151415291936, 0.855757770813), (0.199291748676, -0.938696576291, 0.281303282187), (0.845890508191, 0.30971300752, 0.434220106771)47.8149384765, 3.88072089929, 4.0499173015
2given(0.863361920619, 0.495542071603, 0.0951012581193), (-0.491035688388, 0.868504365818, -0.0677061244152), (-0.116147091024, 0.0117567778656, 0.993162439594)-5.41007579304, 29.9735540499, -7.26092423702
3given(-0.884020663454, -0.460003828929, -0.0830899750706), (-0.44748686764, 0.884183302422, -0.134072334979), (0.135140556, -0.0813410418422, -0.987481982132)44.5919218992, 30.6785148809, 5.47432530456
4given(-0.34945108403, -0.326619866389, 0.878181873389), (0.370921892668, -0.908924634657, -0.190454608908), (0.860407397347, 0.259182313043, 0.438775157907)46.0935415053, 36.8287414213, -4.54927767867
5given(0.467660335556, -0.187950518396, -0.86369462959), (0.200065886421, -0.929265042288, 0.310548099772), (-0.860968902829, -0.318026860212, -0.39697791443)46.0688668566, 3.29648457538, -4.32379374076
6given(0.513989100444, -0.63586633261, -0.575750997982), (-0.000531578542946, -0.671433468426, 0.74106464961), (-0.8577965505, -0.380593095747, -0.345447497343)36.1982556, 38.188550302, 50.0451478059
7given(0.454149532744, 0.890522239698, 0.0268019124704), (-0.860763674355, 0.446337357227, -0.244681140373), (-0.229856691917, 0.0880517129138, 0.969233097368)7.12675656224, 58.8642125879, -13.0876904062

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Components

#1: Protein
Chromosomal replication initiator protein DnaA


Mass: 9770.034 Da / Num. of mol.: 8
Source method: isolated from a genetically manipulated source
Source: (gene. exp.) Bifidobacterium primatium (bacteria) / Gene: dnaA, CS006_03610 / Production host: Escherichia coli (E. coli) / References: UniProt: A0A2M9HC27
#2: Water ChemComp-HOH / water


Mass: 18.015 Da / Num. of mol.: 360 / Source method: isolated from a natural source / Formula: H2O
Has protein modificationN

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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: 2.81 Å3/Da / Density % sol: 56.16 %
Crystal growTemperature: 298 K / Method: vapor diffusion, hanging drop
Details: 9% (w/v) PEG 8000; 50 mM Sodium cacodylate/HCl, pH 6.5; 100 mM Calcium Acetate; 12.5% glycerol

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Data collection

DiffractionMean temperature: 100 K / Serial crystal experiment: N
Diffraction sourceSource: SEALED TUBE / Type: RIGAKU PhotonJet-S / Wavelength: 1.54184 Å
DetectorType: RIGAKU HyPix-6000HE / Detector: PIXEL / Date: Dec 4, 2025
RadiationProtocol: SINGLE WAVELENGTH / Monochromatic (M) / Laue (L): M / Scattering type: x-ray
Radiation wavelengthWavelength: 1.54184 Å / Relative weight: 1
ReflectionResolution: 2.4→22.45 Å / Num. obs: 33680 / % possible obs: 99.8 % / Redundancy: 12 % / Biso Wilson estimate: 37.75 Å2 / CC1/2: 0.999 / Rpim(I) all: 0.017 / Rrim(I) all: 0.064 / Net I/σ(I): 25.4
Reflection shellResolution: 2.4→2.49 Å / Mean I/σ(I) obs: 5.2 / Num. unique obs: 3544 / CC1/2: 0.953 / Rpim(I) all: 0.119 / Rrim(I) all: 0.405

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Processing

Software
NameVersionClassification
PHENIX1.20.1_4487refinement
CrysalisProdata reduction
Aimlessdata scaling
PHASERphasing
RefinementMethod to determine structure: MOLECULAR REPLACEMENT / Resolution: 2.4→22.45 Å / SU ML: 0.315 / Cross valid method: FREE R-VALUE / σ(F): 1.33 / Phase error: 27.2545
Stereochemistry target values: GeoStd + Monomer Library + CDL v1.2
RfactorNum. reflection% reflection
Rfree0.2364 2000 6.04 %
Rwork0.1933 31106 -
obs0.1959 33106 98.33 %
Solvent computationShrinkage radii: 0.9 Å / VDW probe radii: 1.1 Å / Solvent model: FLAT BULK SOLVENT MODEL
Displacement parametersBiso mean: 59.82 Å2
Refinement stepCycle: LAST / Resolution: 2.4→22.45 Å
ProteinNucleic acidLigandSolventTotal
Num. atoms5175 0 0 360 5535
Refine LS restraints
Refine-IDTypeDev idealNumber
X-RAY DIFFRACTIONf_bond_d0.00555306
X-RAY DIFFRACTIONf_angle_d0.86347267
X-RAY DIFFRACTIONf_chiral_restr0.0545900
X-RAY DIFFRACTIONf_plane_restr0.0069952
X-RAY DIFFRACTIONf_dihedral_angle_d13.31221937
Refine LS restraints NCS
Ens-IDDom-IDAsym-IDAuth asym-IDRefine-IDTypeRms dev position (Å)
ens_1d_2AAX-RAY DIFFRACTIONTorsion NCS0.450130201895
ens_1d_3AAX-RAY DIFFRACTIONTorsion NCS0.523446848101
ens_1d_4AAX-RAY DIFFRACTIONTorsion NCS0.510116015454
ens_1d_5AAX-RAY DIFFRACTIONTorsion NCS0.379345325702
ens_1d_6AAX-RAY DIFFRACTIONTorsion NCS0.663987742787
ens_1d_7AAX-RAY DIFFRACTIONTorsion NCS0.623663573966
ens_1d_8AAX-RAY DIFFRACTIONTorsion NCS0.647046042889
LS refinement shell
Resolution (Å)Rfactor RfreeNum. reflection RfreeRfactor RworkNum. reflection RworkRefine-ID% reflection obs (%)
2.4-2.460.34941410.30442200X-RAY DIFFRACTION97.26
2.46-2.530.33571420.26442204X-RAY DIFFRACTION97.83
2.53-2.60.32221390.26592165X-RAY DIFFRACTION97.83
2.6-2.680.32221400.26022184X-RAY DIFFRACTION96.11
2.68-2.780.27181420.25712199X-RAY DIFFRACTION97.14
2.78-2.890.28641420.23482199X-RAY DIFFRACTION97.58
2.89-3.020.30811410.23072200X-RAY DIFFRACTION97.83
3.02-3.180.28351420.2262213X-RAY DIFFRACTION98.12
3.18-3.380.25861420.21222205X-RAY DIFFRACTION98.82
3.38-3.640.21681450.17362264X-RAY DIFFRACTION99.79
3.64-40.23241470.16422285X-RAY DIFFRACTION99.67
4.01-4.580.17041450.14192236X-RAY DIFFRACTION99.42
4.58-5.750.19061460.15742268X-RAY DIFFRACTION99.71
5.75-22.450.19451460.17042284X-RAY DIFFRACTION99.55
Refinement TLS params.

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

IDL112)L122)L132)L222)L232)L332)S11 (Å °)S12 (Å °)S13 (Å °)S21 (Å °)S22 (Å °)S23 (Å °)S31 (Å °)S32 (Å °)S33 (Å °)T112)T122)T132)T222)T232)T332)Origin x (Å)Origin y (Å)Origin z (Å)
16.58267270785-2.223008403021.590662180482.047236035060.06151356389745.115769891320.23537854031-0.0428439237221-0.0794272821727-0.556798034259-0.00502851386249-0.992322470602-0.1743742265750.876270099785-0.04912370140790.205454995646-0.02610088934650.05758646476270.331366736017-0.02124079665310.81166702636223.39584866650.7105542362416.24028026796
22.004509788350.3996315183061.667207489523.169535819410.09709291006676.649405383-0.274836186025-1.210934844330.5016391712160.05079465086970.233188957815-0.238126943526-0.3397816858360.1639728962490.1137776335160.267111173019-0.00535250614802-0.04509270263220.425445072427-0.1140178785460.4542123141819.102587140827.9379136907712.9420949529
35.50566153343-5.2608000331-5.093061377415.01761411154.838946196424.71747613405-0.545726563059-0.653896665551-0.5750735289980.3036365818920.2547770517540.001670450881450.269141714516-0.574873155730.2837943445780.320004929579-0.00393520112564-0.002431165283250.3974369379080.006573295597240.3368645079349.6538128942-2.8481877351714.295631859
45.26418476472.78808934639-0.4875126821388.58560504533-2.225787588494.55395921513-0.3181778158460.136291952545-0.156804847221-0.6618930222130.0274673806586-0.3939263696180.520671154485-0.2652864795940.288244575780.35789319216-0.0618405651370.0694469577390.223302213274-0.1086774656090.49867774579813.6485673961-6.693085471912.91110848418
52.766448072511.27519095577-1.707252344388.38659747394-1.26742033674.119006204950.03129852618230.3160323905420.136107309528-0.359969568293-0.0170368409656-0.518897234121-0.169462863050.153086931503-0.1204068990930.297410239345-0.0264045132315-0.01128770261530.214789754429-0.08210040267060.44143997841915.77245639745.72393415673-0.277664186157
63.804227531020.301529737083-0.6803606036869.162980175760.4496045101412.34845439958-0.236416263974-0.235146236785-0.0767189976407-0.5177996901480.388112731485-0.5001592728340.7640588538930.304751131430.08806008751170.427334682514-0.00674948579565-0.0008213287800260.200200202396-0.0670162383650.35504850550814.0840185297-10.4589932031.39045652827
72.57859480268-0.775496530005-4.037146847792.942370487731.819702703236.612178481310.00812284207943-1.998474083990.2727185822460.4362336227720.429401636351-0.0788377743091-0.00939265017666-0.290712491034-0.1493619338140.4907471567190.05489580190140.09737249280481.01532172404-0.03103917110820.23984095308342.03097393199.2930733202527.0236684147
87.43716656221-1.41721004871-0.7077225540313.944576052122.062351486864.5570603718-0.394533595897-1.055759877510.4204274175160.4258568508060.602560722746-1.5531959415-0.12342754703-0.00662235482778-0.1178813107330.2299471897670.0248026089204-0.06681764809750.457746478695-0.09558766372580.4201107382755.70466146818.2703651709917.7372456804
97.67389833611-1.83164046469-1.314799112355.91336341979-2.369685857726.89350155744-0.0225567715709-0.167450269672-0.16529164603-0.1760772045190.1025831907240.1946011783270.438936040564-0.384267848306-0.06190399344750.240451311707-0.0236692318877-0.02953706966030.413400115205-0.09954539540210.22345743148741.916809923910.762047436215.9050967585
102.00092892059-2.244384635330.3524278134473.21957346428-5.344932039022.00090702149-0.771192147556-1.178758712340.883216322307-1.94251816813-0.129462622269-2.081167774561.005444915644.174955079080.2518823413640.6998798604250.006169362714280.623574952491.33243386313-0.4413380186290.91742788509224.299482568411.4340812582-14.0121204038
118.437538231950.5376490832434.338034192755.897488315081.619620266785.46500347637-0.355473244780.2914518957540.2222395890980.1035890313840.648186977609-0.120896740961-0.04598336519880.682908173237-0.2335262408050.2531952902690.110292107948-0.009754135798850.3335654965660.02509477731640.24048820681914.966695453519.8633332539-2.3268852147
124.40748690234-1.38614395372-1.860462957238.723450622222.518713870736.93844954269-0.06269933688030.7183565944830.252317622163-0.211972512681-0.0152962362396-0.146315328044-0.395807719606-0.6540161499080.02495735116880.1983176305750.0668154870427-0.06004159634360.399986605994-0.02906358797130.2367978366446.0336817113420.0437120108-2.30274955853
136.261797139391.40172051421-1.212267381392.442623668830.1551022649774.055451297-0.3096014404491.579574314560.56485421747-0.559969232470.2483672854650.55080901393-0.26697408192-1.2793842890.124562571570.3664925925770.140752600072-0.07308383897140.6524189607690.02140090645360.3055944577523.8288354914821.602901135-6.11476334403
147.27581597714.19034761966-1.127243214464.01276675102-0.3113592003232.22759822033-0.2278520999930.3987349410570.525115982613-0.4364788240550.5224861222310.697439203637-0.164823055376-0.698078612296-0.1884194268760.2361367779020.0521754599008-0.09446250704930.290786045329-0.05775665630270.45574834070822.61291399420.33004162012.26479509943
154.178925537041.8511357886-4.016966353362.11363283417-1.59014513283.87568944865-0.1503690567581.285743130471.11417423998-1.38703578844-0.174424373317-0.0373162964436-0.4053776689610.2113194973180.2292499309430.694159569582-0.0480633220126-0.1156781967330.6463378454940.150416262190.51194630882135.389888016725.1721236789-6.92333185373
165.3424038465-2.21607956809-1.683148699686.546309169981.214887983665.36087845381-0.0347285987677-0.6698017374820.690965232819-0.322398387673-0.01179727654190.0633572543089-0.6065767939250.13405118880.006625191926810.205225881832-0.00255534342032-0.05876353403380.314012165173-0.1057572222490.37587242599333.34570166920.93544750755.99845226656
172.441643925162.338103985470.380319669852.34427956211.215417856066.80618045214-0.838501342-1.373120742170.3775717645861.481759705180.9786148629050.300044252420.1943938310280.753348213294-0.2138275278490.9206996733480.2296914786770.1705318936320.4896996540120.02769539254060.31801200497841.821624074244.047056445519.9865064014
188.53101417307-3.87407991387-0.2238187568622.416273951341.552554063733.28812578664-0.0968428571525-0.457594068762-0.1240608459010.8032546842930.252953699812-1.061751006670.3300605610010.239806801026-0.2574543856760.5903133973060.1873226061130.0205928968630.376059601377-0.002508262276660.42833366705854.945782619736.95169746149.4252250845
198.29584224099-1.52631651519-1.64563408586.43490525099-0.09573739006213.418901268550.1246231888760.2781795276960.5304778484460.1724254574260.06035201104040.1888315709370.0549233771853-0.170989655342-0.1067069804230.6459825954470.1279799703230.08694899236510.2100964016540.005975991243610.31108128294645.965948712347.56711795956.80036846514
206.80979732162.7084772524-1.999142884322.9783792418-2.760435138693.41580253181-0.2211493954110.2457835365920.398943688509-0.3763162658770.5582444287461.631920603040.236327084588-0.261142615679-0.2437856704040.6492169579640.1503811919680.06546294746120.23969576393-0.0159127724930.57574485810640.782271242141.44817492128.77180865148
210.3098564457860.1498507626680.3009809334260.2263692471680.09770694509930.3077063166060.3396562466660.4955363555960.0153991354173-0.2638508404570.116957573262-0.294477063734-0.189059981726-0.0162447737736-0.2544728334860.798555181061-0.2471895794270.3453596392692.53543645344-0.5801963366021.1001356555765.437767720411.3807390625-33.5113119469
229.710522802874.760934237916.973193109772.817024399463.389084850055.04391733764-0.0711552086050.361663623177-0.02612066057-0.633468741548-0.06186367960510.1894495983690.321163762348-0.4198619227720.1432549638710.684595258765-0.1430587119360.1206403774271.46600072257-0.2726440738950.67344907209250.02507790738.8857762498-26.7807256848
233.890756708530.180031420059-3.149381823676.353205415631.119298858022.83933238971-1.008959317841.12135534526-2.88755559651-0.246160388904-0.784174414166-0.8802242085960.440219309335-1.709850769651.765258786021.2169784553-0.5934770251880.2311662501581.65473499076-0.4265422055861.2313903255636.4486139442.91596580684-17.4835594022
245.95786753012-0.08455933174381.214167218114.037464002013.33548398337.26095460421-0.9183900750350.84570624911-0.78461319560.07799496890630.4039196071420.301997946406-0.21141606448-1.00818950193-0.03843882921990.5284483967810.0801300845145-0.128672472531.50077293994-0.2715313860710.51434165042948.950611630313.3109435193-17.8623622313
254.3379817093-2.27732361313-1.299465936662.430412071072.290916026062.51299187139-0.4218714140760.330235885541-0.2289616414631.07289633847-0.4921961039240.9860065390270.0968426353477-1.867189740280.7106124746110.7180601579780.157307566567-0.00478587461081.25692090745-0.5282938741020.49617237288546.103500354312.3753864741-10.2221037843
260.005529901389240.0185485041816-0.01875982408410.0405564730191-0.05151221709470.07044102855630.124179708052-0.0282099416952-0.2501694694260.6123937242710.109046844609-0.2176246809180.9272506453620.01291534400710.1628812292391.07520134161-0.5003297501040.272717700551.23590589581-1.664787914391.4064152194252.63366086811.12775221916-19.4284860146
277.45275896342.732102979510.4686314826462.42367056299-1.807362529753.32094440939-0.4771804750690.7933147239360.224759347160.1964853795050.761505977877-0.166686893451-0.445514440156-1.493873270310.01623636142510.4942797681990.25034901682-0.196691221191.04842933095-0.2583155780850.42110390589653.165657789715.7103217446-13.9017397356
287.5839956809-2.51202114557-3.80560124028.915322544933.741752303768.261448929150.2974521545660.8449451391560.0925458219815-1.33237082648-0.0561584290836-0.578575708555-0.349966983496-0.0646466092652-0.2778192760331.087732241380.2856428671040.2377686085090.794018354314-0.01168749444620.53095020621843.036277769242.377624022227.8973790037
295.057805557962.98486455445-1.791305682414.09444187753-1.916027417058.672757480110.3351297855930.4575916005390.711796251886-0.42029526795-0.2289181686790.207382874972-0.052649248386-0.699072240816-0.1476219020640.8702587022410.2401908706060.08342244573120.566333164996-0.09171721127820.52528233396841.454712736445.27533196636.7147505724
306.808145449714.252361745254.66726145648.769664746336.228501759236.44054198021-0.03293704264950.051145080037-0.3037173233620.2179227613540.155879943918-0.04803820196740.0868079324187-0.775134490761-0.2005231915370.7569232055980.1947811647670.1303542682410.5849488117840.05140494567160.50517008842.458009328341.518565197339.6535033526
316.43301312547-1.37025895422-1.214692836932.768780535742.395433962023.29337546640.1908325317350.097339495980.951702010269-0.3418475814060.0410969331751-1.43014305052-0.5473299092451.9650072689-0.5843809092570.6126593725020.03930339795060.1594526414660.7351435316850.1577485393680.93913667110918.746337441238.108016812-11.8578278299
322.37511530092-1.600217030141.886080548482.50496121364-0.8385582206412.92619194607-0.161297036827-0.4561989624090.8017597734820.871555336662-1.564540203910.17167821574-0.9417037004660.3725818656241.627384643321.035429891850.0442239523951-0.03805617297520.909541826372-0.16115895820.8659155363311.730090148347.0533566026-1.47695126166
338.697839832760.396265380904-3.437625497738.041107107421.661247180828.678918579180.4814341304750.7645320598251.51465365461-0.546530011325-0.351653289621-0.623155865717-0.867087376517-0.434427985115-0.1863059901370.5685139886510.2061944612390.1681060497350.5301604210580.1176496629220.7521589602257.4619376470943.3744342552-14.0172524663
342.159932574623.360676749720.7395962786615.946416586592.196398287332.34355764520.4260853797050.2381074412030.866424284946-0.494896287784-0.135458015836-1.32299523039-0.6898220921490.824636656373-0.1510404458480.751483968094-0.04519422694870.2230982684260.7057234414720.1475093318961.2525389108214.54002399345.9974476541-16.3289793633
Refinement TLS group

Refine-ID: X-RAY DIFFRACTION

IDRefine TLS-IDSelection detailsAuth asym-IDLabel asym-IDAuth seq-IDLabel seq-ID
11chain 'A' and (resid 3 through 22 )AA3 - 221 - 20
22chain 'A' and (resid 23 through 28 )AA23 - 2821 - 26
33chain 'A' and (resid 29 through 37 )AA29 - 3727 - 35
44chain 'A' and (resid 38 through 64 )AA38 - 6436 - 62
55chain 'A' and (resid 65 through 80 )AA65 - 8063 - 78
66chain 'A' and (resid 81 through 87 )AA81 - 8779 - 85
77chain 'B' and (resid 2 through 23 )BB2 - 231 - 22
88chain 'B' and (resid 24 through 36 )BB24 - 3623 - 35
99chain 'B' and (resid 37 through 87 )BB37 - 8736 - 86
1010chain 'C' and (resid 1 through 5 )CC1 - 51 - 5
1111chain 'C' and (resid 6 through 23 )CC6 - 236 - 23
1212chain 'C' and (resid 24 through 52 )CC24 - 5224 - 52
1313chain 'C' and (resid 53 through 87 )CC53 - 8753 - 87
1414chain 'D' and (resid 1 through 23 )DD1 - 231 - 23
1515chain 'D' and (resid 24 through 37 )DD24 - 3724 - 37
1616chain 'D' and (resid 38 through 87 )DD38 - 8738 - 87
1717chain 'E' and (resid 0 through 23 )EE0 - 231 - 24
1818chain 'E' and (resid 24 through 37 )EE24 - 3725 - 38
1919chain 'E' and (resid 38 through 64 )EE38 - 6439 - 65
2020chain 'E' and (resid 65 through 87 )EE65 - 8766 - 88
2121chain 'F' and (resid 1 through 5 )FF1 - 51 - 5
2222chain 'F' and (resid 6 through 23 )FF6 - 236 - 23
2323chain 'F' and (resid 24 through 28 )FF24 - 2824 - 28
2424chain 'F' and (resid 29 through 54 )FF29 - 5429 - 54
2525chain 'F' and (resid 55 through 64 )FF55 - 6455 - 64
2626chain 'F' and (resid 65 through 80 )FF65 - 8065 - 80
2727chain 'F' and (resid 81 through 87 )FF81 - 8781 - 87
2828chain 'G' and (resid 4 through 23 )GG4 - 231 - 20
2929chain 'G' and (resid 24 through 52 )GG24 - 5221 - 49
3030chain 'G' and (resid 53 through 87 )GG53 - 8750 - 84
3131chain 'H' and (resid 3 through 24 )HH3 - 241 - 22
3232chain 'H' and (resid 25 through 37 )HH25 - 3723 - 35
3333chain 'H' and (resid 38 through 64 )HH38 - 6436 - 62
3434chain 'H' and (resid 65 through 87 )HH65 - 8763 - 85

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