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- PDB-4ksl: Gumby/Fam105B in complex with linear di-ubiquitin -

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Basic information

Entry
Database: PDB / ID: 4ksl
TitleGumby/Fam105B in complex with linear di-ubiquitin
Components
  • Polyubiquitin-C
  • Protein FAM105B
KeywordsHYDROLASE / OTU domain / deubiquitinase / linear diubiquitin
Function / homology
Function and homology information


protein linear deubiquitination / LUBAC complex / nucleotide-binding oligomerization domain containing 2 signaling pathway / regulation of tumor necrosis factor-mediated signaling pathway / regulation of canonical Wnt signaling pathway / sprouting angiogenesis / negative regulation of NF-kappaB transcription factor activity / cysteine-type peptidase activity / Maturation of protein E / Maturation of protein E ...protein linear deubiquitination / LUBAC complex / nucleotide-binding oligomerization domain containing 2 signaling pathway / regulation of tumor necrosis factor-mediated signaling pathway / regulation of canonical Wnt signaling pathway / sprouting angiogenesis / negative regulation of NF-kappaB transcription factor activity / cysteine-type peptidase activity / Maturation of protein E / Maturation of protein E / ER Quality Control Compartment (ERQC) / Myoclonic epilepsy of Lafora / FLT3 signaling by CBL mutants / Prevention of phagosomal-lysosomal fusion / IRAK2 mediated activation of TAK1 complex / Alpha-protein kinase 1 signaling pathway / Glycogen synthesis / IRAK1 recruits IKK complex / IRAK1 recruits IKK complex upon TLR7/8 or 9 stimulation / Membrane binding and targetting of GAG proteins / Endosomal Sorting Complex Required For Transport (ESCRT) / IRAK2 mediated activation of TAK1 complex upon TLR7/8 or 9 stimulation / PTK6 Regulates RTKs and Their Effectors AKT1 and DOK1 / Negative regulation of FLT3 / Constitutive Signaling by NOTCH1 HD Domain Mutants / Regulation of FZD by ubiquitination / TICAM1,TRAF6-dependent induction of TAK1 complex / NOTCH2 Activation and Transmission of Signal to the Nucleus / TICAM1-dependent activation of IRF3/IRF7 / APC/C:Cdc20 mediated degradation of Cyclin B / p75NTR recruits signalling complexes / Downregulation of ERBB4 signaling / APC-Cdc20 mediated degradation of Nek2A / PINK1-PRKN Mediated Mitophagy / TRAF6-mediated induction of TAK1 complex within TLR4 complex / TRAF6 mediated IRF7 activation in TLR7/8 or 9 signaling / Pexophagy / Regulation of innate immune responses to cytosolic DNA / InlA-mediated entry of Listeria monocytogenes into host cells / VLDLR internalisation and degradation / Downregulation of ERBB2:ERBB3 signaling / NF-kB is activated and signals survival / NRIF signals cell death from the nucleus / Regulation of PTEN localization / Activated NOTCH1 Transmits Signal to the Nucleus / Regulation of BACH1 activity / Translesion synthesis by REV1 / Synthesis of active ubiquitin: roles of E1 and E2 enzymes / Translesion synthesis by POLK / MAP3K8 (TPL2)-dependent MAPK1/3 activation / TICAM1, RIP1-mediated IKK complex recruitment / Downregulation of TGF-beta receptor signaling / Activation of IRF3, IRF7 mediated by TBK1, IKKε (IKBKE) / Translesion synthesis by POLI / Gap-filling DNA repair synthesis and ligation in GG-NER / Josephin domain DUBs / Regulation of activated PAK-2p34 by proteasome mediated degradation / InlB-mediated entry of Listeria monocytogenes into host cell / IKK complex recruitment mediated by RIP1 / JNK (c-Jun kinases) phosphorylation and activation mediated by activated human TAK1 / TGF-beta receptor signaling in EMT (epithelial to mesenchymal transition) / N-glycan trimming in the ER and Calnexin/Calreticulin cycle / Autodegradation of Cdh1 by Cdh1:APC/C / TNFR1-induced NF-kappa-B signaling pathway / APC/C:Cdc20 mediated degradation of Securin / Asymmetric localization of PCP proteins / TCF dependent signaling in response to WNT / SCF-beta-TrCP mediated degradation of Emi1 / NIK-->noncanonical NF-kB signaling / Ubiquitin-dependent degradation of Cyclin D / Regulation of NF-kappa B signaling / AUF1 (hnRNP D0) binds and destabilizes mRNA / TNFR2 non-canonical NF-kB pathway / activated TAK1 mediates p38 MAPK activation / Assembly of the pre-replicative complex / Vpu mediated degradation of CD4 / NOTCH3 Activation and Transmission of Signal to the Nucleus / Negative regulators of DDX58/IFIH1 signaling / Deactivation of the beta-catenin transactivating complex / Degradation of DVL / Ubiquitin Mediated Degradation of Phosphorylated Cdc25A / Regulation of signaling by CBL / Dectin-1 mediated noncanonical NF-kB signaling / Cdc20:Phospho-APC/C mediated degradation of Cyclin A / Fanconi Anemia Pathway / Hh mutants are degraded by ERAD / Recognition of DNA damage by PCNA-containing replication complex / Negative regulation of FGFR3 signaling / Peroxisomal protein import / Degradation of AXIN / Degradation of GLI1 by the proteasome / Downregulation of SMAD2/3:SMAD4 transcriptional activity / Activation of NF-kappaB in B cells / Regulation of TNFR1 signaling / Termination of translesion DNA synthesis / Negative regulation of FGFR2 signaling / Hedgehog ligand biogenesis / Defective CFTR causes cystic fibrosis / Stabilization of p53 / EGFR downregulation
Similarity search - Function
Ubiquitin thioesterase otulin / FAM105 / Peptidase family C101 / Phosphatidylinositol 3-kinase Catalytic Subunit; Chain A, domain 1 / Ubiquitin domain signature. / Ubiquitin conserved site / Ubiquitin domain / Ubiquitin-like (UB roll) / Ubiquitin family / Ubiquitin homologues ...Ubiquitin thioesterase otulin / FAM105 / Peptidase family C101 / Phosphatidylinositol 3-kinase Catalytic Subunit; Chain A, domain 1 / Ubiquitin domain signature. / Ubiquitin conserved site / Ubiquitin domain / Ubiquitin-like (UB roll) / Ubiquitin family / Ubiquitin homologues / Ubiquitin domain profile. / Ubiquitin-like domain / Ubiquitin-like domain superfamily / Roll / Alpha Beta
Similarity search - Domain/homology
Polyubiquitin-C / Ubiquitin thioesterase otulin
Similarity search - Component
Biological speciesHomo sapiens (human)
MethodX-RAY DIFFRACTION / SYNCHROTRON / MOLECULAR REPLACEMENT / Resolution: 2.83 Å
AuthorsJuang, Y.-C. / Ceccarelli, D.F. / Sicheri, F.
CitationJournal: Nature / Year: 2013
Title: The linear ubiquitin-specific deubiquitinase gumby regulates angiogenesis.
Authors: Rivkin, E. / Almeida, S.M. / Ceccarelli, D.F. / Juang, Y.C. / MacLean, T.A. / Srikumar, T. / Huang, H. / Dunham, W.H. / Fukumura, R. / Xie, G. / Gondo, Y. / Raught, B. / Gingras, A.C. / ...Authors: Rivkin, E. / Almeida, S.M. / Ceccarelli, D.F. / Juang, Y.C. / MacLean, T.A. / Srikumar, T. / Huang, H. / Dunham, W.H. / Fukumura, R. / Xie, G. / Gondo, Y. / Raught, B. / Gingras, A.C. / Sicheri, F. / Cordes, S.P.
History
DepositionMay 17, 2013Deposition site: RCSB / Processing site: RCSB
Revision 1.0Jun 5, 2013Provider: repository / Type: Initial release
Revision 1.1Jul 3, 2013Group: Database references
Revision 1.2Nov 12, 2014Group: Structure summary
Revision 1.3Feb 28, 2024Group: Data collection / Database references
Category: chem_comp_atom / chem_comp_bond ...chem_comp_atom / chem_comp_bond / database_2 / struct_ref_seq_dif
Item: _database_2.pdbx_DOI / _database_2.pdbx_database_accession / _struct_ref_seq_dif.details
Revision 1.4Apr 3, 2024Group: Refinement description / Category: pdbx_initial_refinement_model

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Structure visualization

Structure viewerMolecule:
MolmilJmol/JSmol

Downloads & links

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Assembly

Deposited unit
A: Protein FAM105B
D: Polyubiquitin-C
B: Protein FAM105B
C: Polyubiquitin-C
E: Protein FAM105B
F: Polyubiquitin-C
G: Protein FAM105B
H: Polyubiquitin-C
I: Protein FAM105B
J: Polyubiquitin-C
K: Protein FAM105B
L: Polyubiquitin-C
M: Protein FAM105B
N: Polyubiquitin-C
O: Protein FAM105B
P: Polyubiquitin-C
Q: Protein FAM105B
R: Polyubiquitin-C
S: Protein FAM105B
T: Polyubiquitin-C
U: Protein FAM105B
V: Polyubiquitin-C
W: Protein FAM105B
X: Polyubiquitin-C


Theoretical massNumber of molelcules
Total (without water)593,92524
Polymers593,92524
Non-polymers00
Water00
1
A: Protein FAM105B
D: Polyubiquitin-C


Theoretical massNumber of molelcules
Total (without water)49,4942
Polymers49,4942
Non-polymers00
Water0
TypeNameSymmetry operationNumber
identity operation1_555x,y,z1
Buried area3490 Å2
ΔGint-7 kcal/mol
Surface area19030 Å2
MethodPISA
2
B: Protein FAM105B
C: Polyubiquitin-C


Theoretical massNumber of molelcules
Total (without water)49,4942
Polymers49,4942
Non-polymers00
Water0
TypeNameSymmetry operationNumber
identity operation1_555x,y,z1
Buried area3550 Å2
ΔGint-5 kcal/mol
Surface area19060 Å2
MethodPISA
3
E: Protein FAM105B
F: Polyubiquitin-C


Theoretical massNumber of molelcules
Total (without water)49,4942
Polymers49,4942
Non-polymers00
Water0
TypeNameSymmetry operationNumber
identity operation1_555x,y,z1
Buried area3490 Å2
ΔGint-4 kcal/mol
Surface area18820 Å2
MethodPISA
4
G: Protein FAM105B
H: Polyubiquitin-C


Theoretical massNumber of molelcules
Total (without water)49,4942
Polymers49,4942
Non-polymers00
Water0
TypeNameSymmetry operationNumber
identity operation1_555x,y,z1
Buried area3510 Å2
ΔGint-2 kcal/mol
Surface area18730 Å2
MethodPISA
5
I: Protein FAM105B
J: Polyubiquitin-C


Theoretical massNumber of molelcules
Total (without water)49,4942
Polymers49,4942
Non-polymers00
Water0
TypeNameSymmetry operationNumber
identity operation1_555x,y,z1
Buried area3490 Å2
ΔGint-6 kcal/mol
Surface area19120 Å2
MethodPISA
6
K: Protein FAM105B
L: Polyubiquitin-C


Theoretical massNumber of molelcules
Total (without water)49,4942
Polymers49,4942
Non-polymers00
Water0
TypeNameSymmetry operationNumber
identity operation1_555x,y,z1
Buried area3500 Å2
ΔGint-5 kcal/mol
Surface area19230 Å2
MethodPISA
7
M: Protein FAM105B
N: Polyubiquitin-C


Theoretical massNumber of molelcules
Total (without water)49,4942
Polymers49,4942
Non-polymers00
Water0
TypeNameSymmetry operationNumber
identity operation1_555x,y,z1
Buried area3520 Å2
ΔGint-9 kcal/mol
Surface area19060 Å2
MethodPISA
8
O: Protein FAM105B
P: Polyubiquitin-C


Theoretical massNumber of molelcules
Total (without water)49,4942
Polymers49,4942
Non-polymers00
Water0
TypeNameSymmetry operationNumber
identity operation1_555x,y,z1
Buried area3520 Å2
ΔGint-4 kcal/mol
Surface area19270 Å2
MethodPISA
9
Q: Protein FAM105B
R: Polyubiquitin-C


Theoretical massNumber of molelcules
Total (without water)49,4942
Polymers49,4942
Non-polymers00
Water0
TypeNameSymmetry operationNumber
identity operation1_555x,y,z1
Buried area3510 Å2
ΔGint-3 kcal/mol
Surface area19010 Å2
MethodPISA
10
S: Protein FAM105B
T: Polyubiquitin-C


Theoretical massNumber of molelcules
Total (without water)49,4942
Polymers49,4942
Non-polymers00
Water0
TypeNameSymmetry operationNumber
identity operation1_555x,y,z1
Buried area3520 Å2
ΔGint-5 kcal/mol
Surface area18890 Å2
MethodPISA
11
U: Protein FAM105B
V: Polyubiquitin-C


Theoretical massNumber of molelcules
Total (without water)49,4942
Polymers49,4942
Non-polymers00
Water0
TypeNameSymmetry operationNumber
identity operation1_555x,y,z1
Buried area3560 Å2
ΔGint-6 kcal/mol
Surface area19030 Å2
MethodPISA
12
W: Protein FAM105B
X: Polyubiquitin-C


Theoretical massNumber of molelcules
Total (without water)49,4942
Polymers49,4942
Non-polymers00
Water0
TypeNameSymmetry operationNumber
identity operation1_555x,y,z1
Buried area3430 Å2
ΔGint-6 kcal/mol
Surface area18670 Å2
MethodPISA
Unit cell
Length a, b, c (Å)183.622, 186.087, 219.698
Angle α, β, γ (deg.)90.00, 90.00, 90.00
Int Tables number18
Space group name H-MP21212

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Components

#1: Protein
Protein FAM105B


Mass: 32041.746 Da / Num. of mol.: 12 / Fragment: OTU domain (unp residues 79-352) / Mutation: C129A
Source method: isolated from a genetically manipulated source
Source: (gene. exp.) Homo sapiens (human) / Gene: FAM105B / Plasmid: pRoEX / Production host: Escherichia coli (E. coli) / Strain (production host): BL21(DE3) / References: UniProt: Q96BN8
#2: Protein
Polyubiquitin-C / Ubiquitin


Mass: 17452.031 Da / Num. of mol.: 12 / Fragment: linear diubiquitin (unp residues 76-228)
Source method: isolated from a genetically manipulated source
Source: (gene. exp.) Homo sapiens (human) / Gene: UBC / Plasmid: pETm30 / Production host: Escherichia coli (E. coli) / Strain (production host): BL21(DE3) / References: UniProt: P0CG48

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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: 3.16 Å3/Da / Density % sol: 61.07 %
Crystal growTemperature: 298 K / pH: 5.5
Details: 100mM acetate, 100mM CaCl2, 100 mM glycine, 2.5M sodium formate, 24% PEG3350 , pH 5.5, VAPOR DIFFUSION, HANGING DROP, temperature 298K

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Data collection

DiffractionMean temperature: 100 K
Diffraction sourceSource: SYNCHROTRON / Site: APS / Beamline: 24-ID-C / Wavelength: 0.9792
DetectorType: DECTRIS PILATUS 6M / Detector: PIXEL / Date: Feb 27, 2013
RadiationMonochromator: SI(111) / Protocol: SINGLE WAVELENGTH / Monochromatic (M) / Laue (L): M / Scattering type: x-ray
Radiation wavelengthWavelength: 0.9792 Å / Relative weight: 1
ReflectionResolution: 2.83→50 Å / Num. obs: 173426 / % possible obs: 99.9 % / Observed criterion σ(I): 1.37
Reflection shellResolution: 2.8→2.9 Å / % possible all: 99.9

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Processing

Software
NameVersionClassification
ADSCQuantumdata collection
PHASERphasing
PHENIX(phenix.refine: 1.8.1_1168)refinement
HKL-3000data reduction
HKL-3000data scaling
RefinementMethod to determine structure: MOLECULAR REPLACEMENT
Starting model: GUMBY/FAM105B UBIQUITIN

Resolution: 2.83→50 Å / SU ML: 0.36 / σ(F): 1.37 / Phase error: 29.81 / Stereochemistry target values: ML
RfactorNum. reflection% reflection
Rfree0.254 8692 5.01 %
Rwork0.224 --
obs0.226 173426 96.7 %
all-173695 -
Solvent computationShrinkage radii: 0.9 Å / VDW probe radii: 1.11 Å / Solvent model: FLAT BULK SOLVENT MODEL
Refinement stepCycle: LAST / Resolution: 2.83→50 Å
ProteinNucleic acidLigandSolventTotal
Num. atoms40089 0 0 0 40089
Refine LS restraints
Refine-IDTypeDev idealNumber
X-RAY DIFFRACTIONf_bond_d0.00440819
X-RAY DIFFRACTIONf_angle_d0.97955125
X-RAY DIFFRACTIONf_dihedral_angle_d13.68215731
X-RAY DIFFRACTIONf_chiral_restr0.0666218
X-RAY DIFFRACTIONf_plane_restr0.0047053
LS refinement shell
Resolution (Å)Rfactor RfreeNum. reflection RfreeRfactor RworkNum. reflection RworkRefine-ID% reflection obs (%)
2.8286-2.86080.3833970.33921725X-RAY DIFFRACTION31
2.8608-2.89440.37162300.33664399X-RAY DIFFRACTION78
2.8944-2.92970.35362900.33125568X-RAY DIFFRACTION99
2.9297-2.96680.35683110.325630X-RAY DIFFRACTION100
2.9668-3.00580.34742990.3285620X-RAY DIFFRACTION100
3.0058-3.0470.33662830.31635645X-RAY DIFFRACTION100
3.047-3.09050.33642860.30595603X-RAY DIFFRACTION100
3.0905-3.13660.34112910.28865618X-RAY DIFFRACTION100
3.1366-3.18560.30443170.29165621X-RAY DIFFRACTION100
3.1856-3.23790.32153010.29495612X-RAY DIFFRACTION100
3.2379-3.29370.34952870.285651X-RAY DIFFRACTION100
3.2937-3.35360.27282930.28065634X-RAY DIFFRACTION100
3.3536-3.41810.32783410.2675566X-RAY DIFFRACTION100
3.4181-3.48780.29392800.26125683X-RAY DIFFRACTION100
3.4878-3.56360.29572700.24945629X-RAY DIFFRACTION100
3.5636-3.64650.26452810.24885683X-RAY DIFFRACTION100
3.6465-3.73770.29033010.24155649X-RAY DIFFRACTION100
3.7377-3.83870.2662990.22625658X-RAY DIFFRACTION100
3.8387-3.95160.26112750.21785670X-RAY DIFFRACTION100
3.9516-4.07910.24922870.21355688X-RAY DIFFRACTION100
4.0791-4.22480.2542820.19425677X-RAY DIFFRACTION100
4.2248-4.39390.20433230.19045628X-RAY DIFFRACTION100
4.3939-4.59370.19773050.17125676X-RAY DIFFRACTION100
4.5937-4.83570.20992880.17125707X-RAY DIFFRACTION100
4.8357-5.13840.19813200.18665700X-RAY DIFFRACTION100
5.1384-5.53470.23883080.19365706X-RAY DIFFRACTION100
5.5347-6.09080.23993080.20545743X-RAY DIFFRACTION100
6.0908-6.97010.2373250.21335706X-RAY DIFFRACTION99
6.9701-8.77390.21652950.18785822X-RAY DIFFRACTION100
8.7739-50.05440.1893190.18925817X-RAY DIFFRACTION97
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)
17.5969-3.3688-0.16644.82411.78371.8293-0.2672-0.5218-0.00740.25110.2019-0.03250.16560.37510.07990.8634-0.0547-0.02150.6188-0.01740.4372-21.507330.2729-4.5605
23.16721.47160.67373.70691.20052.65570.2078-0.020.5123-0.2234-0.49830.47630.0525-0.49390.22280.5955-0.00580.06220.7955-0.13830.6374-45.826436.3833-13.357
36.48231.6304-0.99034.1127-1.61760.8804-0.277-0.0026-0.47310.4103-0.03581.14060.8027-1.7675-0.04890.6841-0.13050.20621.0416-0.23211.0736-58.783122.761-18.4127
44.9345.22965.74165.17635.84736.55750.5643-0.82620.62021.0358-1.06511.15420.2158-0.73160.61610.60230.0471-0.0760.9197-0.16350.7912-55.054637.3908-10.6705
55.0387-2.28850.18292.30830.93598.31870.0492-0.84260.26180.4170.30290.63290.2125-0.5463-0.22590.7274-0.14860.09140.8424-0.12050.6134-43.848743.1821-0.7781
64.5449-0.89811.44392.82271.2738.9034-0.12440.08660.0048-0.1113-0.70920.3560.0342-0.61120.88720.7147-0.0497-0.07550.7482-0.15310.7609-49.392830.5001-20.9713
73.96550.15350.93664.74082.08334.15640.01230.6438-0.3537-0.4896-0.23470.5933-0.0761-0.24460.17750.6951-0.0819-0.02390.8735-0.13480.7137-43.086125.2187-25.9491
84.218-1.06910.45174.7140.12321.93180.02870.24740.0149-0.0497-0.1108-0.01790.11570.08650.06270.6555-0.0420.02360.65220.04780.6213-29.840635.3081-16.6616
90.70032.30971.35317.38354.28662.42920.75241.63541.5313-1.23410.0878-1.55990.21960.5931-0.43471.00070.13430.02171.6887-0.07650.6995-22.157724.2646-35.485
104.45161.02091.70074.60160.95138.62040.12741.6637-0.9563-0.89630.0479-1.01960.4111.7821-0.17961.07070.2218-0.03861.6331-0.34420.8159-21.619913.0585-34.533
113.6467-1.88635.18795.7941-2.02758.60230.22411.3743-0.5553-0.1107-0.13550.6363-0.03121.7951-0.19380.9310.22870.02651.2287-0.14180.7226-31.357116.6961-31.1761
126.146-1.7094-0.19927.40373.02892.0403-0.1131.21020.2897-0.67430.107-0.00440.930.9639-0.04160.96320.19430.15971.4867-0.10260.7325-28.756716.1973-42.316
136.09261.7735-4.48573.082-2.42193.89130.517-0.11160.0949-0.26720.40470.5881.31410.4038-0.88860.7541-0.0529-0.02650.77310.08360.5701-33.624419.7407-20.3436
143.1668-3.64833.39224.3708-4.27353.94010.2131-0.91330.74331.1047-0.1856-0.4807-0.5831-0.4272-0.30530.979-0.055-0.00780.75780.01750.5528-28.438617.17381.959
152.7899-0.57442.53284.4152-0.7435.21540.47380.3167-0.32350.4458-0.2823-0.05350.80210.3491-0.03550.8914-0.05790.07590.6314-0.10110.6653-23.022111.6416-6.0964
163.4445-0.52481.94562.39321.43642.46780.4431-0.3149-0.2376-1.34430.2041-0.32322.03460.6722-1.230.9377-0.0190.03230.9294-0.07080.9235-30.98963.6534-6.2822
174.2159-1.03072.23034.3477-1.10816.93920.12780.2629-0.44450.32060.11280.36370.6605-0.6829-0.10371.0824-0.23340.10660.7465-0.09830.7477-31.45919.1661-2.4758
184.10535.3237-0.20157.8332-1.57993.0969-0.58290.7707-0.0547-0.41120.4465-0.2612-0.3553-0.00230.19460.6443-0.0081-0.04510.4816-0.08610.567486.516430.7069-108.9183
199.15933.11070.66853.7391-0.26441.62650.23190.20580.85280.0622-0.10870.3863-0.053-0.3584-0.12890.71490.00780.02890.4211-0.03390.397686.794132.407-101.4867
202.2611-0.48811.17147.051-0.90874.6452-0.10020.1460.1222-0.4810.3013-0.0125-0.49090.0097-0.2290.5035-0.06390.00820.4452-0.08120.5208106.026241.9519-96.8416
216.02920.94051.78672.8969-3.43455.8156-0.0654-0.4051-0.0980.0667-0.3594-1.5558-0.12890.83480.35440.773-0.042-0.00770.89220.03150.8568121.637729.595-88.4802
227.5246-6.09515.7125.325-5.78817.08510.76060.13440.5103-0.7938-0.697-0.74120.13950.8293-0.03870.5765-0.10030.05330.59760.06350.678117.096938.559-98.7103
237.0283-0.717-0.36082.5234-2.08182.33-0.3160.2441-0.3156-0.65460.23451.2870.06790.03730.03420.6904-0.06230.0720.67080.03310.6088105.853644.4403-108.6092
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257.8057-1.65353.72733.61020.33565.97320.347-0.40750.58710.2565-0.5468-0.22440.05850.04730.35580.9222-0.1639-0.03640.9155-0.13520.7973103.821231.2718-74.5268
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1228.0685-0.81370.09818.165-4.51032.60210.03780.6049-0.8707-0.4962-0.0954-0.3110.00440.7158-0.09790.69220.1636-0.00860.9786-0.26940.54648.063430.1686-22.587
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1253.2593-1.19680.2292.2479-3.45376.95310.1114-0.130.0489-0.00950.07131.2605-0.2874-0.6235-0.04920.72580.132-0.07760.9138-0.25640.701739.026734.1354-16.6511
1264.5091-0.9595-0.71047.89931.55865.75060.25170.29010.4387-0.25810.0374-0.11-0.4023-0.0833-0.43280.50240.01080.03730.54170.08920.515162.603548.9979-104.9928
1275.54291.3171-1.17723.2915-0.80091.22740.1297-0.0451-0.34430.2462-0.19-0.3557-0.18160.08420.08420.5595-0.0354-0.06370.4416-0.00820.484953.588623.7212-96.399
1283.64181.2730.74473.1042-0.6588.31080.17370.9176-1.2077-0.57-0.38980.7241.0541-0.70230.25380.5981-0.0814-0.03160.5570.03060.785434.679518.1226-96.2026
1294.69322.0789-5.62792.3791-1.66877.0281-0.10560.6935-0.0209-0.04180.15920.36550.0629-0.4741-0.07110.6406-0.00430.04540.5147-0.09530.814152.99615.6037-101.0899
1302.0303-3.6536-0.85837.11750.1299.02650.31310.01750.3257-0.5391-0.0562-0.05570.1934-0.4318-0.11370.6483-0.0748-0.03270.5536-0.06120.537763.260623.5745-110.1323
1315.2176-1.326-2.35554.3041-0.10042.0276-0.5195-0.1931-0.1414-0.0076-0.4002-0.2040.03650.47670.68490.6002-0.0107-0.09160.49060.0390.641148.656323.3099-90.4764
1323.7485-0.8773-1.31162.78560.7126.37740.09-0.39490.13480.33580.0346-0.1624-0.1592-0.1737-0.08620.6256-0.0705-0.04230.5609-0.00580.536446.926831.3585-85.2507
1333.4789-1.2549-2.09845.0314-0.44151.8294-0.0104-0.20170.23610.2119-0.0945-0.268-0.080.02150.0680.566-0.0145-0.09780.57330.03150.609362.484938.6754-93.3824
1344.4059-4.19-4.73055.34474.21795.0090.8456-1.01171.51790.70160.1046-1.4973-0.3520.1866-0.92990.9681-0.1708-0.02730.9193-0.15420.847155.233249.5966-74.1433
1352.78151.6086-2.07932.2794-0.48762.77010.3535-1.17751.9924-0.5462-0.17070.167-2.15691.1867-0.12071.0982-0.12110.14540.8411-0.13250.961245.632755.5065-75.5986
1365.76040.1868-1.60095.34442.15775.7784-0.0197-0.53920.3637-0.2189-0.13860.0307-0.46870.21450.0370.92670.09870.00270.65430.04560.78242.495646.1494-77.795
1372.9906-1.0416-3.63934.55931.67528.15150.2584-0.21630.48820.4324-0.0605-0.2156-0.5670.0121-0.17270.5754-0.035-0.04810.6461-0.04530.52747.02245.4967-74.5072
1382.84823.3438-4.62249.9434-5.36847.8125-0.30110.6879-0.4052-0.36710.2078-0.01090.5651-0.6935-0.12680.7011-0.09340.02720.67970.12790.661246.159847.254-109.5065
1395.9748-2.20454.11247.7766-2.12224.47350.56620.60150.0081-0.2765-0.0147-0.1864-0.30880.2966-0.52450.5971-0.01290.09250.60210.05460.67546.963649.7908-106.3281
1402.4431.88293.05548.0079-0.47376.6444-0.07910.39980.3582-0.03120.37870.1803-1.3056-0.3438-0.45850.7270.08880.19170.65110.18050.618746.200858.8412-105.3635
1414.5833-3.41024.06276.3469-5.12988.5557-0.6867-0.36580.95140.27790.47720.2366-0.6202-1.09310.03820.82780.09770.06780.8690.18680.993634.679853.5154-103.9468
1426.3444-6.2529-6.26596.14926.22256.3906-0.3709-1.1181-0.2340.87770.81710.57471.0553-0.3306-0.24430.8248-0.03170.0380.6880.15180.600237.635444.3266-103.6348
1436.13241.66951.6646.4932-3.88158.86280.49040.71521.1348-1.1934-0.19791.7949-0.3051-0.7468-0.15270.58020.15150.08150.87580.27880.958241.46958.1483-112.6303
1442.9043.09182.20773.72150.95065.6586-0.293-0.75230.56240.2542-0.14420.2846-0.2063-0.02290.49920.71180.08570.05180.676-0.03350.5729-26.403560.3891-1.1522
1451.846-0.96431.84858.4082-1.58755.11380.25280.1537-0.1299-0.6667-0.2911-0.0779-0.1869-0.88910.07230.799-0.0118-0.00160.7726-0.17610.5729-27.861653.2457-10.7418
1464.006-0.6557-0.65195.2147-1.54873.2962-0.0451-0.18160.1598-0.00130.0740.0084-0.6182-0.0771-0.06530.6771-0.0222-0.01630.6187-0.0660.4825-16.462569.0509-7.7916
1475.2468-4.00631.97238.1633-3.48693.6743-0.19231.55521.4182-0.8559-0.5931-1.2764-0.15280.19930.6461.0682-0.14850.13851.04370.21320.9846-1.373981.8588-20.6448
1482.1908-0.9567-0.77357.3256-3.90568.8137-0.35590.19311.6127-0.7170.0072-1.3313-0.060.12340.51751.4309-0.03360.19540.91020.11291.3747-13.289592.5835-19.2705
1494.1503-3.08042.7554.1032-5.5876.7727-0.7268-0.32610.40030.51810.7463-0.4563-0.53180.0387-0.0460.9836-0.1177-0.00010.7267-0.12230.5734-3.841674.642-5.2286
1505.6669-0.56553.08244.3699-2.17448.426-0.51761.23060.7224-0.2977-0.1628-0.0528-0.50170.70880.89531.1085-0.17440.05070.92010.18690.8481-12.45581.1187-21.5887
1513.41630.98570.45936.2325-0.22074.61830.02441.33620.5427-0.91560.04160.1773-0.8423-0.3615-0.06231.2168-0.00020.13831.17150.27530.7915-20.575580.2066-30.1117
1527.6531-1.7678-1.72012.6884-0.59192.7928-0.04540.85620.13550.04790.15380.30350.7983-0.2204-0.18191.0841-0.04510.03390.84450.040.5145-20.162575.1344-20.4111
1533.03043.4463-0.72446.4567-1.21063.0671-0.39421.1909-0.6354-0.70510.0679-0.2997-0.4848-0.24430.32690.7901-0.00690.07960.8013-0.10710.4732-17.73461.4368-21.6005
1546.6436-1.825-0.89944.6364-2.37041.13350.33340.8747-0.2606-0.0030.00720.046-0.90070.4742-0.29860.6255-0.04430.09950.6062-0.1380.4367-18.759763.1678-10.4545
1551.3946-0.67650.73741.11151.31415.17450.11651.42650.1273-0.4673-0.20980.0247-0.4087-1.18390.09210.9469-0.11110.01531.69060.0080.5511-35.2268.2633-32.284
1564.19740.2511-1.65314.4905-1.38774.113-0.06060.17150.2245-0.3981-0.02710.408-0.1861-0.33020.12960.78970.0664-0.07810.767-0.1240.6077-41.624172.2585-5.2044
1578.9229-4.21221.2452.5078-0.84334.636-0.04711.11050.0619-0.2605-0.18760.1167-0.18580.13050.21250.7821-0.12320.02780.5430.06990.766487.988761.2703-108.7008
1586.2153-2.71540.2256.4430.22313.29190.2489-0.2128-0.1180.55040.02430.2486-0.24750.2301-0.29690.6276-0.11630.07610.47820.00780.414986.309160.8623-101.3777
1591.4336-0.18610.94053.98681.11431.24750.2694-0.55361.45050.21780.03591.0656-0.9473-0.2832-0.08951.1046-0.04450.42070.6911-0.19781.445368.323283.3416-94.6111
1603.97684.22863.1734.83113.0153.08590.30910.98761.22160.66720.42350.3657-0.26610.3415-0.580.84530.02080.13590.73770.20141.114866.3870.8129-109.0727
1614.22831.34074.0684.41952.22199.70010.0323-0.91720.88740.6759-0.40960.6055-1.0666-1.69590.31651.0997-0.09430.46930.7709-0.22331.494374.040882.493-89.0313
1622.3835-0.3759-0.95922.6760.83031.70710.5964-1.12491.14331.0335-0.29640.2411-0.78280.2536-0.27551.191-0.2520.31350.8252-0.27190.918581.572276.7997-85.4492
1637.89580.8585-1.53223.52771.39043.25590.3952-1.22330.34770.5759-0.24350.2855-0.46680.3079-0.22020.7715-0.1040.20720.62470.02280.611979.903162.9194-93.2743
1644.3684-1.12123.78753.3193-1.39183.46840.6453-1.466-0.21771.35050.50320.1514-0.19150.7827-0.98071.7476-0.31170.28421.7133-0.28140.86294.378563.6832-71.0032
1659.31254.65426.157.46333.55777.38370.6158-2.1706-0.90210.6459-0.2041-1.3086-1.53870.2381-0.23571.3595-0.42840.13161.8503-0.15650.888897.800664.9882-72.7087
1665.9862-2.38571.20477.54351.89391.5997-0.0249-0.426-0.0224-0.1660.5434-1.0319-0.37270.7442-0.4161.667-0.3186-0.00161.7183-0.03560.7891102.488367.3634-78.5516
1674.1135-2.9489-2.77423.2969-0.80517.25180.5288-1.36090.79151.5821-1.01810.02380.71111.17960.55821.4051-0.50240.20411.6678-0.34430.900796.486975.6138-77.1952
1684.91160.89241.41173.3377-2.89414.6716-0.2791-0.0366-0.19540.64490.612-0.0909-0.35410.2115-0.00331.801-0.35670.08891.4345-0.07241.033595.693270.7834-66.8819
1690.3108-0.40420.8750.5754-1.97118.78981.0356-0.81851.50660.8957-0.49660.0934-0.41941.259-0.8241.3227-0.2740.0811.1504-0.24270.800691.301475.1291-90.452
1705.1641-4.8531-4.86895.28394.45444.71050.65861.61520.2848-1.15840.2068-0.4022-0.6264-1.0842-0.43180.9042-0.11660.09260.8298-0.08550.579498.394671.5576-112.9276
1717.78541.72011.31856.72410.69684.32520.462-1.04021.07451.4258-0.45510.45110.13260.40230.12030.6496-0.1230.10470.6133-0.11970.738796.351372.4882-101.3087
1725.1669-1.21810.23179.0696-0.78994.36630.1305-0.1350.4405-0.24440.0737-0.8262-0.13420.2931-0.26170.7779-0.18120.10360.5596-0.05510.6582106.075170.0061-105.0946
1732.03172.1090.60045.30983.11442.11840.6299-1.17261.56821.749-0.37750.136-0.88220.7351-0.01080.9871-0.19790.02540.8483-0.18860.8412105.900879.8058-98.7193
1745.589-1.4415-1.39964.77061.97534.54241.0383-0.02081.0647-0.083-0.5196-0.8096-0.68430.331-0.61190.8477-0.14340.0150.53750.03910.9002102.103876.264-108.4024
1757.9703-2.92812.29764.85571.3932.31380.23820.10120.285-0.503-0.54820.2657-0.7304-0.10740.21611.1960.07820.05530.64140.02580.514277.129363.0058-20.802
1767.10372.6588-1.55476.481-1.56372.2597-0.0243-0.4087-0.071-1.7633-0.2791-1.0575-0.45140.50070.25851.3040.00330.36070.7034-0.13830.750488.848763.5017-21.9117
1775.3582-1.2348-2.5323.729-1.39973.86750.52190.45330.0967-1.17890.1649-1.2585-0.95370.3906-0.77471.3044-0.11140.29770.8827-0.21811.1339102.537956.6925-29.5574
1781.91760.1952-2.47093.32490.59093.120.1365-0.1196-0.2361-1.30520.280.2379-0.1210.08590.53851.3933-0.10390.55581.103-0.05861.9513113.443272.0662-38.2555
1795.4736.6338-2.8748.4982-4.24842.22210.9958-0.03971.33380.7221-0.7532-2.157-1.39440.649-0.23751.2833-0.23870.50350.9954-0.13912.0738111.466661.9263-27.1115
1804.87391.01910.20681.00921.28237.2722-0.39130.44491.4381-0.28750.7917-1.0611-1.06840.1298-0.58020.8922-0.16690.12520.9736-0.27811.205101.519154.3705-16.7466
1814.042-2.19864.50021.2114-1.49088.98420.04861.23920.8214-1.1458-0.2191-1.06960.52752.68840.54851.9025-0.29250.89851.0979-0.13181.8174104.539467.5751-37.4814
1822.1357-1.0574-2.02852.04431.80382.7198-0.03242.0870.02620.2345-0.26270.0329-0.0387-2.40790.71252.80590.32761.0871.50020.14931.224897.064166.1853-51.4845
1833.730.28171.1072.1407-0.96965.7827-0.5940.9120.269-1.4278-0.5503-0.9756-1.6862-0.42650.36822.9664-0.07671.18970.74160.05661.628698.115677.4-39.3662
1843.8107-1.8217-1.0014.36121.12253.51220.43560.74730.246-2.1521-0.2195-0.4941-1.04560.0575-0.26181.70450.04450.31150.8307-0.08370.744187.924760.1302-33.9714
1853.81873.0130.06244.86582.26941.96840.05080.554-0.5145-1.0755-0.81361.13931.62380.86510.121.82480.3423-0.01621.54070.03220.864475.173969.8373-55.1413
1863.0764-1.01770.40858.8802-2.86486.20391.61241.0207-0.0378-2.0347-0.95371.627-0.21430.4849-0.04641.88030.23360.08081.6515-0.00071.069874.734272.9681-52.9895
1878.61420.44880.2414.29810.4914.08930.8711-0.5591.08430.8357-1.34481.2430.7789-0.23270.09831.88460.18240.34071.56680.1281.137973.872779.1462-47.5097
1885.2706-1.2927-2.69862.44670.82997.25590.5510.77010.0488-0.9004-0.6326-0.27-2.7038-0.75310.24052.47080.33440.23971.3449-0.0310.927383.269877.2133-47.2822
1891.256-0.04120.55551.85120.4070.60790.97470.24560.68520.1021-0.33910.1457-1.56830.7772-0.52072.46960.38810.58531.69170.36451.661881.806183.9081-57.2312
1907.3151-0.20285.91788.1090.42334.8288-1.12960.1224-0.70571.66662.20230.5532-1.58370.6633-0.75121.86230.12050.27821.48580.08340.93579.651971.8805-58.5453
1915.93210.3408-0.29243.9607-2.84296.0061-0.56560.2445-0.2755-2.9589-0.2893-1.0557-0.3231-0.89820.83672.2546-0.09040.36990.82430.03060.944887.280875.3515-37.4503
1928.9338-2.9704-0.02978.66912.85981.14870.55970.17320.1207-1.64710.4835-0.0766-1.51130.5667-0.90731.3487-0.04760.21740.79060.0290.853382.325377.9028-19.3886
1938.02462.34280.73715.1317-0.95743.02420.51660.48850.5905-0.4334-0.12730.0217-0.3045-0.0063-0.26751.66320.17560.18170.6822-0.05090.711474.58283.4091-20.8801
1943.63962.5097-0.58342.312-2.12394.75430.26230.05841.407-2.27860.2460.67310.18590.2707-0.01952.03060.10820.27340.78440.03521.123881.874889.6604-27.2267
1954.7114-1.6727-2.72853.77522.22774.35170.91660.10660.8494-0.217-0.2844-0.5587-0.68360.3562-0.71171.699-0.01650.18910.6197-0.07430.90181.903184.3316-17.48
1967.98756.33281.92926.18050.58853.3885-0.37050.23610.1516-0.44240.09450.07370.06750.02360.3630.71570.03430.04320.35860.03690.4435-17.603463.7022-92.6164
1976.76621.36970.04863.71542.23821.18110.1362-0.1125-0.61450.3548-0.1156-0.1902-0.23210.17340.05750.8189-0.01220.03610.59360.190.4803-18.410862.2038-85.3968
1984.81910.62550.04854.65810.33832.96020.3588-0.79740.49560.4908-0.27581.2089-0.3732-0.5578-0.0260.69290.03990.18060.7692-0.03550.792-46.920863.6544-78.2812
1996.11751.01990.54692.01744.33289.77890.03110.0368-0.0782-0.11750.28-0.3325-0.4127-0.5352-0.50930.62550.0886-0.02520.73060.1640.6612-39.363653.9272-92.8871
2005.75750.77880.02917.43044.42123.07090.3326-1.18670.3410.7864-1.17410.78610.2553-0.95581.07690.7572-0.09710.20990.9235-0.08530.8389-42.724767.9127-72.847
2013.72921.1864-2.1893.0822-0.25765.80950.472-1.66250.45980.8108-0.58720.7296-0.58630.1413-0.06081.0494-0.14960.27161.1619-0.19550.8214-36.127673.9996-66.8907
2025.24970.7014-1.10163.59031.46581.75760.3062-0.9499-0.25170.599-0.1489-0.0447-0.201-0.4094-0.14190.7192-0.04130.02440.71270.17420.4937-25.900160.2303-75.8031
2030.40160.88331.46582.68320.69814.68860.5877-1.27470.20561.4659-0.8025-0.0745-1.02430.65340.11191.5646-0.57380.10461.6943-0.05920.6998-17.964576.5103-58.9767
2048.10340.9826-0.81924.3714-2.01474.03820.03-0.26910.85980.02110.10280.149-0.4709-0.0699-0.06430.75950.02550.01440.4222-0.020.518-16.944382.4821-89.6503
Refinement TLS group
IDRefine-IDRefine TLS-IDSelection details
1X-RAY DIFFRACTION1chain 'A' and (resid 79 through 116 )
2X-RAY DIFFRACTION2chain 'A' and (resid 117 through 164 )
3X-RAY DIFFRACTION3chain 'A' and (resid 165 through 183 )
4X-RAY DIFFRACTION4chain 'A' and (resid 184 through 203 )
5X-RAY DIFFRACTION5chain 'A' and (resid 204 through 222 )
6X-RAY DIFFRACTION6chain 'A' and (resid 223 through 248 )
7X-RAY DIFFRACTION7chain 'A' and (resid 249 through 298 )
8X-RAY DIFFRACTION8chain 'A' and (resid 299 through 348 )
9X-RAY DIFFRACTION9chain 'D' and (resid 1 through 16 )
10X-RAY DIFFRACTION10chain 'D' and (resid 17 through 34 )
11X-RAY DIFFRACTION11chain 'D' and (resid 35 through 50 )
12X-RAY DIFFRACTION12chain 'D' and (resid 51 through 68 )
13X-RAY DIFFRACTION13chain 'D' and (resid 69 through 1001 )
14X-RAY DIFFRACTION14chain 'D' and (resid 1002 through 1016 )
15X-RAY DIFFRACTION15chain 'D' and (resid 1017 through 1044 )
16X-RAY DIFFRACTION16chain 'D' and (resid 1045 through 1056 )
17X-RAY DIFFRACTION17chain 'D' and (resid 1057 through 1073 )
18X-RAY DIFFRACTION18chain 'B' and (resid 79 through 100 )
19X-RAY DIFFRACTION19chain 'B' and (resid 101 through 128 )
20X-RAY DIFFRACTION20chain 'B' and (resid 129 through 151 )
21X-RAY DIFFRACTION21chain 'B' and (resid 152 through 183 )
22X-RAY DIFFRACTION22chain 'B' and (resid 184 through 203 )
23X-RAY DIFFRACTION23chain 'B' and (resid 204 through 222 )
24X-RAY DIFFRACTION24chain 'B' and (resid 223 through 248 )
25X-RAY DIFFRACTION25chain 'B' and (resid 249 through 262 )
26X-RAY DIFFRACTION26chain 'B' and (resid 263 through 298 )
27X-RAY DIFFRACTION27chain 'B' and (resid 299 through 348 )
28X-RAY DIFFRACTION28chain 'C' and (resid 0 through 1001 )
29X-RAY DIFFRACTION29chain 'C' and (resid 1002 through 1055 )
30X-RAY DIFFRACTION30chain 'C' and (resid 1056 through 1073 )
31X-RAY DIFFRACTION31chain 'E' and (resid 79 through 100 )
32X-RAY DIFFRACTION32chain 'E' and (resid 101 through 128 )
33X-RAY DIFFRACTION33chain 'E' and (resid 129 through 151 )
34X-RAY DIFFRACTION34chain 'E' and (resid 152 through 183 )
35X-RAY DIFFRACTION35chain 'E' and (resid 184 through 203 )
36X-RAY DIFFRACTION36chain 'E' and (resid 204 through 222 )
37X-RAY DIFFRACTION37chain 'E' and (resid 223 through 248 )
38X-RAY DIFFRACTION38chain 'E' and (resid 249 through 287 )
39X-RAY DIFFRACTION39chain 'E' and (resid 288 through 327 )
40X-RAY DIFFRACTION40chain 'E' and (resid 328 through 348 )
41X-RAY DIFFRACTION41chain 'F' and (resid 0 through 22 )
42X-RAY DIFFRACTION42chain 'F' and (resid 23 through 40 )
43X-RAY DIFFRACTION43chain 'F' and (resid 41 through 55 )
44X-RAY DIFFRACTION44chain 'F' and (resid 56 through 68 )
45X-RAY DIFFRACTION45chain 'F' and (resid 69 through 76 )
46X-RAY DIFFRACTION46chain 'F' and (resid 1001 through 1006 )
47X-RAY DIFFRACTION47chain 'F' and (resid 1007 through 1022 )
48X-RAY DIFFRACTION48chain 'F' and (resid 1023 through 1044 )
49X-RAY DIFFRACTION49chain 'F' and (resid 1045 through 1054 )
50X-RAY DIFFRACTION50chain 'F' and (resid 1055 through 1065 )
51X-RAY DIFFRACTION51chain 'F' and (resid 1066 through 1073 )
52X-RAY DIFFRACTION52chain 'G' and (resid 79 through 100 )
53X-RAY DIFFRACTION53chain 'G' and (resid 101 through 116 )
54X-RAY DIFFRACTION54chain 'G' and (resid 117 through 128 )
55X-RAY DIFFRACTION55chain 'G' and (resid 129 through 151 )
56X-RAY DIFFRACTION56chain 'G' and (resid 152 through 183 )
57X-RAY DIFFRACTION57chain 'G' and (resid 184 through 203 )
58X-RAY DIFFRACTION58chain 'G' and (resid 204 through 222 )
59X-RAY DIFFRACTION59chain 'G' and (resid 223 through 248 )
60X-RAY DIFFRACTION60chain 'G' and (resid 249 through 262 )
61X-RAY DIFFRACTION61chain 'G' and (resid 263 through 348 )
62X-RAY DIFFRACTION62chain 'H' and (resid 1 through 76 )
63X-RAY DIFFRACTION63chain 'H' and (resid 1001 through 1073 )
64X-RAY DIFFRACTION64chain 'I' and (resid 79 through 100 )
65X-RAY DIFFRACTION65chain 'I' and (resid 101 through 128 )
66X-RAY DIFFRACTION66chain 'I' and (resid 129 through 151 )
67X-RAY DIFFRACTION67chain 'I' and (resid 152 through 203 )
68X-RAY DIFFRACTION68chain 'I' and (resid 204 through 222 )
69X-RAY DIFFRACTION69chain 'I' and (resid 223 through 248 )
70X-RAY DIFFRACTION70chain 'I' and (resid 249 through 279 )
71X-RAY DIFFRACTION71chain 'I' and (resid 280 through 298 )
72X-RAY DIFFRACTION72chain 'I' and (resid 299 through 328 )
73X-RAY DIFFRACTION73chain 'I' and (resid 329 through 348 )
74X-RAY DIFFRACTION74chain 'J' and (resid 0 through 22 )
75X-RAY DIFFRACTION75chain 'J' and (resid 23 through 34 )
76X-RAY DIFFRACTION76chain 'J' and (resid 35 through 50 )
77X-RAY DIFFRACTION77chain 'J' and (resid 51 through 60 )
78X-RAY DIFFRACTION78chain 'J' and (resid 61 through 68 )
79X-RAY DIFFRACTION79chain 'J' and (resid 69 through 1001 )
80X-RAY DIFFRACTION80chain 'J' and (resid 1002 through 1011 )
81X-RAY DIFFRACTION81chain 'J' and (resid 1012 through 1022 )
82X-RAY DIFFRACTION82chain 'J' and (resid 1023 through 1044 )
83X-RAY DIFFRACTION83chain 'J' and (resid 1045 through 1056 )
84X-RAY DIFFRACTION84chain 'J' and (resid 1057 through 1065 )
85X-RAY DIFFRACTION85chain 'J' and (resid 1066 through 1073 )
86X-RAY DIFFRACTION86chain 'K' and (resid 79 through 100 )
87X-RAY DIFFRACTION87chain 'K' and (resid 101 through 128 )
88X-RAY DIFFRACTION88chain 'K' and (resid 129 through 164 )
89X-RAY DIFFRACTION89chain 'K' and (resid 165 through 180 )
90X-RAY DIFFRACTION90chain 'K' and (resid 181 through 203 )
91X-RAY DIFFRACTION91chain 'K' and (resid 204 through 222 )
92X-RAY DIFFRACTION92chain 'K' and (resid 223 through 248 )
93X-RAY DIFFRACTION93chain 'K' and (resid 249 through 287 )
94X-RAY DIFFRACTION94chain 'K' and (resid 288 through 348 )
95X-RAY DIFFRACTION95chain 'L' and (resid 0 through 22 )
96X-RAY DIFFRACTION96chain 'L' and (resid 23 through 50 )
97X-RAY DIFFRACTION97chain 'L' and (resid 51 through 59 )
98X-RAY DIFFRACTION98chain 'L' and (resid 60 through 76 )
99X-RAY DIFFRACTION99chain 'L' and (resid 1001 through 1022 )
100X-RAY DIFFRACTION100chain 'L' and (resid 1023 through 1034 )
101X-RAY DIFFRACTION101chain 'L' and (resid 1035 through 1044 )
102X-RAY DIFFRACTION102chain 'L' and (resid 1045 through 1054 )
103X-RAY DIFFRACTION103chain 'L' and (resid 1055 through 1065 )
104X-RAY DIFFRACTION104chain 'L' and (resid 1066 through 1073 )
105X-RAY DIFFRACTION105chain 'M' and (resid 79 through 114 )
106X-RAY DIFFRACTION106chain 'M' and (resid 115 through 128 )
107X-RAY DIFFRACTION107chain 'M' and (resid 129 through 151 )
108X-RAY DIFFRACTION108chain 'M' and (resid 152 through 186 )
109X-RAY DIFFRACTION109chain 'M' and (resid 187 through 222 )
110X-RAY DIFFRACTION110chain 'M' and (resid 223 through 248 )
111X-RAY DIFFRACTION111chain 'M' and (resid 249 through 306 )
112X-RAY DIFFRACTION112chain 'M' and (resid 307 through 348 )
113X-RAY DIFFRACTION113chain 'N' and (resid 0 through 6 )
114X-RAY DIFFRACTION114chain 'N' and (resid 7 through 22 )
115X-RAY DIFFRACTION115chain 'N' and (resid 23 through 34 )
116X-RAY DIFFRACTION116chain 'N' and (resid 35 through 50 )
117X-RAY DIFFRACTION117chain 'N' and (resid 51 through 60 )
118X-RAY DIFFRACTION118chain 'N' and (resid 61 through 68 )
119X-RAY DIFFRACTION119chain 'N' and (resid 69 through 1001 )
120X-RAY DIFFRACTION120chain 'N' and (resid 1002 through 1011 )
121X-RAY DIFFRACTION121chain 'N' and (resid 1012 through 1022 )
122X-RAY DIFFRACTION122chain 'N' and (resid 1023 through 1034 )
123X-RAY DIFFRACTION123chain 'N' and (resid 1035 through 1050 )
124X-RAY DIFFRACTION124chain 'N' and (resid 1051 through 1059 )
125X-RAY DIFFRACTION125chain 'N' and (resid 1060 through 1073 )
126X-RAY DIFFRACTION126chain 'O' and (resid 79 through 116 )
127X-RAY DIFFRACTION127chain 'O' and (resid 117 through 169 )
128X-RAY DIFFRACTION128chain 'O' and (resid 170 through 184 )
129X-RAY DIFFRACTION129chain 'O' and (resid 185 through 203 )
130X-RAY DIFFRACTION130chain 'O' and (resid 204 through 222 )
131X-RAY DIFFRACTION131chain 'O' and (resid 223 through 248 )
132X-RAY DIFFRACTION132chain 'O' and (resid 249 through 298 )
133X-RAY DIFFRACTION133chain 'O' and (resid 299 through 348 )
134X-RAY DIFFRACTION134chain 'P' and (resid 1 through 16 )
135X-RAY DIFFRACTION135chain 'P' and (resid 17 through 34 )
136X-RAY DIFFRACTION136chain 'P' and (resid 35 through 55 )
137X-RAY DIFFRACTION137chain 'P' and (resid 56 through 76 )
138X-RAY DIFFRACTION138chain 'P' and (resid 1001 through 1007 )
139X-RAY DIFFRACTION139chain 'P' and (resid 1008 through 1022 )
140X-RAY DIFFRACTION140chain 'P' and (resid 1023 through 1044 )
141X-RAY DIFFRACTION141chain 'P' and (resid 1045 through 1056 )
142X-RAY DIFFRACTION142chain 'P' and (resid 1057 through 1065 )
143X-RAY DIFFRACTION143chain 'P' and (resid 1066 through 1073 )
144X-RAY DIFFRACTION144chain 'Q' and (resid 79 through 100 )
145X-RAY DIFFRACTION145chain 'Q' and (resid 101 through 116 )
146X-RAY DIFFRACTION146chain 'Q' and (resid 117 through 141 )
147X-RAY DIFFRACTION147chain 'Q' and (resid 142 through 164 )
148X-RAY DIFFRACTION148chain 'Q' and (resid 165 through 187 )
149X-RAY DIFFRACTION149chain 'Q' and (resid 188 through 222 )
150X-RAY DIFFRACTION150chain 'Q' and (resid 223 through 248 )
151X-RAY DIFFRACTION151chain 'Q' and (resid 249 through 279 )
152X-RAY DIFFRACTION152chain 'Q' and (resid 280 through 297 )
153X-RAY DIFFRACTION153chain 'Q' and (resid 298 through 327 )
154X-RAY DIFFRACTION154chain 'Q' and (resid 328 through 348 )
155X-RAY DIFFRACTION155chain 'R' and (resid 0 through 1007 )
156X-RAY DIFFRACTION156chain 'R' and (resid 1008 through 1073 )
157X-RAY DIFFRACTION157chain 'S' and (resid 79 through 100 )
158X-RAY DIFFRACTION158chain 'S' and (resid 101 through 128 )
159X-RAY DIFFRACTION159chain 'S' and (resid 129 through 203 )
160X-RAY DIFFRACTION160chain 'S' and (resid 204 through 222 )
161X-RAY DIFFRACTION161chain 'S' and (resid 223 through 248 )
162X-RAY DIFFRACTION162chain 'S' and (resid 249 through 309 )
163X-RAY DIFFRACTION163chain 'S' and (resid 310 through 348 )
164X-RAY DIFFRACTION164chain 'T' and (resid 1 through 7 )
165X-RAY DIFFRACTION165chain 'T' and (resid 8 through 22 )
166X-RAY DIFFRACTION166chain 'T' and (resid 23 through 34 )
167X-RAY DIFFRACTION167chain 'T' and (resid 35 through 54 )
168X-RAY DIFFRACTION168chain 'T' and (resid 55 through 69 )
169X-RAY DIFFRACTION169chain 'T' and (resid 70 through 1001 )
170X-RAY DIFFRACTION170chain 'T' and (resid 1002 through 1011 )
171X-RAY DIFFRACTION171chain 'T' and (resid 1012 through 1022 )
172X-RAY DIFFRACTION172chain 'T' and (resid 1023 through 1049 )
173X-RAY DIFFRACTION173chain 'T' and (resid 1050 through 1059 )
174X-RAY DIFFRACTION174chain 'T' and (resid 1060 through 1073 )
175X-RAY DIFFRACTION175chain 'U' and (resid 79 through 115 )
176X-RAY DIFFRACTION176chain 'U' and (resid 116 through 128 )
177X-RAY DIFFRACTION177chain 'U' and (resid 129 through 153 )
178X-RAY DIFFRACTION178chain 'U' and (resid 154 through 183 )
179X-RAY DIFFRACTION179chain 'U' and (resid 184 through 203 )
180X-RAY DIFFRACTION180chain 'U' and (resid 204 through 222 )
181X-RAY DIFFRACTION181chain 'U' and (resid 223 through 248 )
182X-RAY DIFFRACTION182chain 'U' and (resid 249 through 261 )
183X-RAY DIFFRACTION183chain 'U' and (resid 262 through 287 )
184X-RAY DIFFRACTION184chain 'U' and (resid 288 through 348 )
185X-RAY DIFFRACTION185chain 'V' and (resid 0 through 7 )
186X-RAY DIFFRACTION186chain 'V' and (resid 8 through 22 )
187X-RAY DIFFRACTION187chain 'V' and (resid 23 through 33 )
188X-RAY DIFFRACTION188chain 'V' and (resid 34 through 50 )
189X-RAY DIFFRACTION189chain 'V' and (resid 51 through 59 )
190X-RAY DIFFRACTION190chain 'V' and (resid 60 through 69 )
191X-RAY DIFFRACTION191chain 'V' and (resid 70 through 76 )
192X-RAY DIFFRACTION192chain 'V' and (resid 1001 through 1022 )
193X-RAY DIFFRACTION193chain 'V' and (resid 1023 through 1049 )
194X-RAY DIFFRACTION194chain 'V' and (resid 1050 through 1059 )
195X-RAY DIFFRACTION195chain 'V' and (resid 1060 through 1073 )
196X-RAY DIFFRACTION196chain 'W' and (resid 79 through 100 )
197X-RAY DIFFRACTION197chain 'W' and (resid 101 through 128 )
198X-RAY DIFFRACTION198chain 'W' and (resid 129 through 203 )
199X-RAY DIFFRACTION199chain 'W' and (resid 204 through 222 )
200X-RAY DIFFRACTION200chain 'W' and (resid 223 through 248 )
201X-RAY DIFFRACTION201chain 'W' and (resid 249 through 287 )
202X-RAY DIFFRACTION202chain 'W' and (resid 288 through 348 )
203X-RAY DIFFRACTION203chain 'X' and (resid 1 through 76 )
204X-RAY DIFFRACTION204chain 'X' and (resid 1001 through 1073 )

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