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- PDB-6nz7: Crystal structure of broadly neutralizing Influenza A antibody 42... -

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Basic information

Entry
Database: PDB / ID: 6nz7
TitleCrystal structure of broadly neutralizing Influenza A antibody 429 B01 in complex with Hemagglutinin Hong Kong 1968
Components
  • (Hemagglutinin ...) x 2
  • 429 B01 FAB heavy chain
  • 429 B01 FAB light chain
KeywordsIMMUNE SYSTEM / Antibody / Influenza / neutralization
Function / homology
Function and homology information


viral budding from plasma membrane / clathrin-dependent endocytosis of virus by host cell / host cell surface receptor binding / fusion of virus membrane with host plasma membrane / fusion of virus membrane with host endosome membrane / viral envelope / virion attachment to host cell / host cell plasma membrane / virion membrane / extracellular region ...viral budding from plasma membrane / clathrin-dependent endocytosis of virus by host cell / host cell surface receptor binding / fusion of virus membrane with host plasma membrane / fusion of virus membrane with host endosome membrane / viral envelope / virion attachment to host cell / host cell plasma membrane / virion membrane / extracellular region / metal ion binding / membrane / plasma membrane
Similarity search - Function
Hemagglutinin Ectodomain; Chain B - #10 / Hemagglutinin Ectodomain; Chain B / Hemagglutinin (Ha1 Chain); Chain: A; domain 1 / Haemagglutinin, alpha/beta domain, HA1 chain / : / Haemagglutinin, influenzavirus A / Haemagglutinin, HA1 chain, alpha/beta domain superfamily / Haemagglutinin / Haemagglutinin, influenzavirus A/B / Viral capsid/haemagglutinin protein ...Hemagglutinin Ectodomain; Chain B - #10 / Hemagglutinin Ectodomain; Chain B / Hemagglutinin (Ha1 Chain); Chain: A; domain 1 / Haemagglutinin, alpha/beta domain, HA1 chain / : / Haemagglutinin, influenzavirus A / Haemagglutinin, HA1 chain, alpha/beta domain superfamily / Haemagglutinin / Haemagglutinin, influenzavirus A/B / Viral capsid/haemagglutinin protein / : / Immunoglobulin V-Type / Immunoglobulin V-set domain / Immunoglobulin V-set domain / Immunoglobulin subtype / Immunoglobulin / Immunoglobulin/major histocompatibility complex, conserved site / Immunoglobulins and major histocompatibility complex proteins signature. / Immunoglobulin C-Type / Immunoglobulin C1-set / Immunoglobulin C1-set domain / Ig-like domain profile. / Immunoglobulin-like domain / Immunoglobulin-like domain superfamily / Immunoglobulin-like fold / Immunoglobulins / Alpha-Beta Complex / Immunoglobulin-like / Sandwich / Mainly Beta / Alpha Beta
Similarity search - Domain/homology
Ig-like domain-containing protein / Ig-like domain-containing protein / Hemagglutinin
Similarity search - Component
Biological speciesInfluenza A virus
Homo sapiens (human)
MethodX-RAY DIFFRACTION / SYNCHROTRON / MOLECULAR REPLACEMENT / Resolution: 2.95 Å
AuthorsZhou, T. / Kwong, P.D.
CitationJournal: Sci Immunol / Year: 2019
Title: Prolonged evolution of the memory B cell response induced by a replicating adenovirus-influenza H5 vaccine.
Authors: Matsuda, K. / Huang, J. / Zhou, T. / Sheng, Z. / Kang, B.H. / Ishida, E. / Griesman, T. / Stuccio, S. / Bolkhovitinov, L. / Wohlbold, T.J. / Chromikova, V. / Cagigi, A. / Leung, K. / ...Authors: Matsuda, K. / Huang, J. / Zhou, T. / Sheng, Z. / Kang, B.H. / Ishida, E. / Griesman, T. / Stuccio, S. / Bolkhovitinov, L. / Wohlbold, T.J. / Chromikova, V. / Cagigi, A. / Leung, K. / Andrews, S. / Cheung, C.S.F. / Pullano, A.A. / Plyler, J. / Soto, C. / Zhang, B. / Yang, Y. / Joyce, M.G. / Tsybovsky, Y. / Wheatley, A. / Narpala, S.R. / Guo, Y. / Darko, S. / Bailer, R.T. / Poole, A. / Liang, C.J. / Smith, J. / Alexander, J. / Gurwith, M. / Migueles, S.A. / Koup, R.A. / Golding, H. / Khurana, S. / McDermott, A.B. / Shapiro, L. / Krammer, F. / Kwong, P.D. / Connors, M.
History
DepositionFeb 13, 2019Deposition site: RCSB / Processing site: RCSB
Revision 1.0May 8, 2019Provider: repository / Type: Initial release
Revision 1.1Jul 29, 2020Group: Data collection / Derived calculations / Structure summary
Category: chem_comp / entity ...chem_comp / entity / pdbx_chem_comp_identifier / pdbx_entity_nonpoly / struct_conn / struct_site / struct_site_gen
Item: _chem_comp.name / _chem_comp.type ..._chem_comp.name / _chem_comp.type / _entity.pdbx_description / _pdbx_entity_nonpoly.name / _struct_conn.pdbx_role
Description: Carbohydrate remediation / Provider: repository / Type: Remediation
Revision 1.2Oct 16, 2024Group: Data collection / Database references / Structure summary
Category: chem_comp / chem_comp_atom ...chem_comp / chem_comp_atom / chem_comp_bond / database_2 / pdbx_entry_details / pdbx_modification_feature
Item: _chem_comp.pdbx_synonyms / _database_2.pdbx_DOI / _database_2.pdbx_database_accession

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Structure visualization

Structure viewerMolecule:
MolmilJmol/JSmol

Downloads & links

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Assembly

Deposited unit
A: Hemagglutinin HA1 chain
B: Hemagglutinin HA2 chain
H: 429 B01 FAB heavy chain
L: 429 B01 FAB light chain
E: Hemagglutinin HA1 chain
F: Hemagglutinin HA2 chain
G: 429 B01 FAB heavy chain
I: 429 B01 FAB light chain
hetero molecules


Theoretical massNumber of molelcules
Total (without water)207,65119
Polymers205,2178
Non-polymers2,43311
Water34219
1
A: Hemagglutinin HA1 chain
B: Hemagglutinin HA2 chain
H: 429 B01 FAB heavy chain
L: 429 B01 FAB light chain
hetero molecules


Theoretical massNumber of molelcules
Total (without water)103,93610
Polymers102,6094
Non-polymers1,3276
Water724
TypeNameSymmetry operationNumber
identity operation1_555x,y,z1
Buried area11260 Å2
ΔGint-39 kcal/mol
Surface area42440 Å2
MethodPISA
2
E: Hemagglutinin HA1 chain
F: Hemagglutinin HA2 chain
G: 429 B01 FAB heavy chain
I: 429 B01 FAB light chain
hetero molecules


Theoretical massNumber of molelcules
Total (without water)103,7159
Polymers102,6094
Non-polymers1,1065
Water543
TypeNameSymmetry operationNumber
identity operation1_555x,y,z1
Buried area11290 Å2
ΔGint-49 kcal/mol
Surface area42300 Å2
MethodPISA
Unit cell
Length a, b, c (Å)91.769, 123.905, 119.338
Angle α, β, γ (deg.)90.000, 112.000, 90.000
Int Tables number4
Space group name H-MP1211
Noncrystallographic symmetry (NCS)NCS domain:
IDEns-IDDetails
11(chain G and (resseq 1:126 or resseq 128 or resseq...
21(chain H and (resseq 1:126 or resseq 128 or resseq...
12(chain L and (resseq 2:52 or resseq 54:108 or (resid...
22(chain I and (resseq 2:52 or resseq 54:108 or (resid...
13(chain B and (resseq 4:18 or resseq 20:61 or (resid...
23(chain F and (resseq 4:18 or resseq 20:61 or (resid...

NCS domain segments:
Dom-IDComponent-IDEns-IDSelection detailsAuth asym-IDAuth seq-ID
111(chain G and (resseq 1:126 or resseq 128 or resseq...G1 - 126
121(chain G and (resseq 1:126 or resseq 128 or resseq...G128
131(chain G and (resseq 1:126 or resseq 128 or resseq...G130 - 137
141(chain G and (resseq 1:126 or resseq 128 or resseq...G147 - 200
151(chain G and (resseq 1:126 or resseq 128 or resseq...G202 - 217
161(chain G and (resseq 1:126 or resseq 128 or resseq...G219 - 225
211(chain H and (resseq 1:126 or resseq 128 or resseq...H1 - 126
221(chain H and (resseq 1:126 or resseq 128 or resseq...H128
231(chain H and (resseq 1:126 or resseq 128 or resseq...H130 - 137
241(chain H and (resseq 1:126 or resseq 128 or resseq...H147 - 200
251(chain H and (resseq 1:126 or resseq 128 or resseq...H202 - 217
261(chain H and (resseq 1:126 or resseq 128 or resseq...H219 - 225
112(chain L and (resseq 2:52 or resseq 54:108 or (resid...L2 - 52
122(chain L and (resseq 2:52 or resseq 54:108 or (resid...L54 - 108
132(chain L and (resseq 2:52 or resseq 54:108 or (resid...L0
142(chain L and (resseq 2:52 or resseq 54:108 or (resid...L1 - 214
152(chain L and (resseq 2:52 or resseq 54:108 or (resid...L1 - 214
162(chain L and (resseq 2:52 or resseq 54:108 or (resid...L1 - 214
172(chain L and (resseq 2:52 or resseq 54:108 or (resid...L1 - 214
182(chain L and (resseq 2:52 or resseq 54:108 or (resid...L1 - 214
192(chain L and (resseq 2:52 or resseq 54:108 or (resid...L1 - 214
212(chain I and (resseq 2:52 or resseq 54:108 or (resid...I2 - 52
222(chain I and (resseq 2:52 or resseq 54:108 or (resid...I54 - 108
232(chain I and (resseq 2:52 or resseq 54:108 or (resid...I109
242(chain I and (resseq 2:52 or resseq 54:108 or (resid...I1 - 214
252(chain I and (resseq 2:52 or resseq 54:108 or (resid...I1 - 214
262(chain I and (resseq 2:52 or resseq 54:108 or (resid...I1 - 214
272(chain I and (resseq 2:52 or resseq 54:108 or (resid...I1 - 214
113(chain B and (resseq 4:18 or resseq 20:61 or (resid...B4 - 18
123(chain B and (resseq 4:18 or resseq 20:61 or (resid...B20 - 61
133(chain B and (resseq 4:18 or resseq 20:61 or (resid...B62
143(chain B and (resseq 4:18 or resseq 20:61 or (resid...B4 - 654
153(chain B and (resseq 4:18 or resseq 20:61 or (resid...B4 - 654
163(chain B and (resseq 4:18 or resseq 20:61 or (resid...B4 - 654
173(chain B and (resseq 4:18 or resseq 20:61 or (resid...B4 - 654
183(chain B and (resseq 4:18 or resseq 20:61 or (resid...B4 - 654
193(chain B and (resseq 4:18 or resseq 20:61 or (resid...B4 - 654
213(chain F and (resseq 4:18 or resseq 20:61 or (resid...F4 - 18
223(chain F and (resseq 4:18 or resseq 20:61 or (resid...F20 - 61
233(chain F and (resseq 4:18 or resseq 20:61 or (resid...F62
243(chain F and (resseq 4:18 or resseq 20:61 or (resid...F4 - 654
253(chain F and (resseq 4:18 or resseq 20:61 or (resid...F4 - 654
263(chain F and (resseq 4:18 or resseq 20:61 or (resid...F4 - 654
273(chain F and (resseq 4:18 or resseq 20:61 or (resid...F4 - 654
283(chain F and (resseq 4:18 or resseq 20:61 or (resid...F4 - 654
293(chain F and (resseq 4:18 or resseq 20:61 or (resid...F4 - 654

NCS ensembles :
ID
1
2
3

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Components

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Hemagglutinin ... , 2 types, 4 molecules AEBF

#1: Protein Hemagglutinin HA1 chain


Mass: 35154.539 Da / Num. of mol.: 2 / Fragment: residues 24-342
Source method: isolated from a genetically manipulated source
Source: (gene. exp.) Influenza A virus (strain A/Hong Kong/1/1968 H3N2)
Strain: A/Hong Kong/1/1968 H3N2 / Gene: HA / Cell line (production host): 293F / Production host: Homo sapiens (human) / References: UniProt: Q91MA7
#2: Protein Hemagglutinin HA2 chain


Mass: 19980.070 Da / Num. of mol.: 2 / Fragment: residues 349-521
Source method: isolated from a genetically manipulated source
Source: (gene. exp.) Influenza A virus (strain A/Hong Kong/1/1968 H3N2)
Strain: A/Hong Kong/1/1968 H3N2 / Gene: HA / Cell line (production host): 293F / Production host: Homo sapiens (human) / References: UniProt: Q91MA7

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Antibody , 2 types, 4 molecules HGLI

#3: Antibody 429 B01 FAB heavy chain


Mass: 24123.068 Da / Num. of mol.: 2
Source method: isolated from a genetically manipulated source
Source: (gene. exp.) Homo sapiens (human) / Cell line (production host): 293F / Production host: Homo sapiens (human) / References: UniProt: A8K008
#4: Antibody 429 B01 FAB light chain


Mass: 23350.951 Da / Num. of mol.: 2
Source method: isolated from a genetically manipulated source
Source: (gene. exp.) Homo sapiens (human) / Plasmid: pVRC8400 / Cell line (production host): 293F / Production host: Homo sapiens (human) / References: UniProt: Q8TCD0

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Sugars / Non-polymers , 2 types, 30 molecules

#5: Sugar
ChemComp-NAG / 2-acetamido-2-deoxy-beta-D-glucopyranose / N-acetyl-beta-D-glucosamine / 2-acetamido-2-deoxy-beta-D-glucose / 2-acetamido-2-deoxy-D-glucose / 2-acetamido-2-deoxy-glucose / N-ACETYL-D-GLUCOSAMINE


Type: D-saccharide, beta linking / Mass: 221.208 Da / Num. of mol.: 11
Source method: isolated from a genetically manipulated source
Formula: C8H15NO6 / Feature type: SUBJECT OF INVESTIGATION
IdentifierTypeProgram
DGlcpNAcbCONDENSED IUPAC CARBOHYDRATE SYMBOLGMML 1.0
N-acetyl-b-D-glucopyranosamineCOMMON NAMEGMML 1.0
b-D-GlcpNAcIUPAC CARBOHYDRATE SYMBOLPDB-CARE 1.0
GlcNAcSNFG CARBOHYDRATE SYMBOLGMML 1.0
#6: Water ChemComp-HOH / water


Mass: 18.015 Da / Num. of mol.: 19 / Source method: isolated from a natural source / Formula: H2O

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Details

Has protein modificationY

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Experimental details

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Experiment

ExperimentMethod: X-RAY DIFFRACTION / Number of used crystals: 1

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Sample preparation

CrystalDensity Matthews: 2.83 Å3/Da / Density % sol: 56.47 %
Crystal growTemperature: 300 K / Method: vapor diffusion, hanging drop / pH: 8.5
Details: 10 % PEG8000 (w/v), 100 mM Tris/Cl, pH 8.5 and 7.5 % 1,6-hexanediol (w/v)

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Data collection

DiffractionMean temperature: 100 K / Ambient temp details: liquid nitrogen stream / Serial crystal experiment: N
Diffraction sourceSource: SYNCHROTRON / Site: APS / Beamline: 22-ID / Wavelength: 1 Å
DetectorType: MARMOSAIC 325 mm CCD / Detector: CCD / Date: Mar 23, 2017
RadiationProtocol: SINGLE WAVELENGTH / Monochromatic (M) / Laue (L): M / Scattering type: x-ray
Radiation wavelengthWavelength: 1 Å / Relative weight: 1
ReflectionResolution: 2.95→50 Å / Num. obs: 49672 / % possible obs: 94.7 % / Redundancy: 3.1 % / Biso Wilson estimate: 89.08 Å2 / Rmerge(I) obs: 0.105 / Rpim(I) all: 0.069 / Rrim(I) all: 0.126 / Χ2: 2.192 / Net I/σ(I): 8.5
Reflection shell

Diffraction-ID: 1

Resolution (Å)Redundancy (%)Rmerge(I) obsNum. unique obsCC1/2Rpim(I) allRrim(I) allΧ2% possible all
2.95-31.70.50915430.70.4170.6611.03559.3
3-3.061.80.47918790.7820.3770.6121.01271.6
3.06-3.1120.47421590.8230.3590.5970.93183.1
3.11-3.182.30.55624420.7580.4160.6980.91993.2
3.18-3.252.50.54725530.740.3970.6790.95197.4
3.25-3.322.90.48625630.8540.340.5950.93898.9
3.32-3.413.10.44426200.8890.2970.5361.05699.7
3.41-3.53.30.39225860.9070.2560.471.37999.8
3.5-3.63.50.32426270.9360.2020.3821.26299.9
3.6-3.723.50.30925950.9440.1930.3651.86899.8
3.72-3.853.60.24526290.9670.1520.2891.699.8
3.85-43.60.21226120.9660.1330.2512.19299.8
4-4.193.60.14726120.9840.0920.1732.17499.8
4.19-4.413.50.11626140.9870.0740.1372.57299.8
4.41-4.683.50.09926120.9890.0640.1183.09499.5
4.68-5.043.40.09226100.9870.060.113.25199.6
5.04-5.553.50.08326150.990.0540.0993.19799.4
5.55-6.353.50.07826390.990.050.0933.22899.5
6.35-83.40.06726200.990.0440.083.42399.4
8-5030.05225420.9930.0360.0633.82493.8

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Processing

Software
NameVersionClassification
PHENIX(1.10.1_2155)refinement
HKL-2000data reduction
SCALEPACKdata scaling
PHASERphasing
RefinementMethod to determine structure: MOLECULAR REPLACEMENT / Resolution: 2.95→42.225 Å / SU ML: 0.45 / Cross valid method: THROUGHOUT / σ(F): 1.34 / Phase error: 33.59
RfactorNum. reflection% reflection
Rfree0.2674 2503 5.05 %
Rwork0.2236 --
obs0.2258 49589 93.51 %
Solvent computationShrinkage radii: 0.9 Å / VDW probe radii: 1.11 Å
Displacement parametersBiso max: 293.64 Å2 / Biso mean: 124.2972 Å2 / Biso min: 52.74 Å2
Refinement stepCycle: final / Resolution: 2.95→42.225 Å
ProteinNucleic acidLigandSolventTotal
Num. atoms14125 0 154 19 14298
Biso mean--106.41 90.73 -
Num. residues----1829
Refine LS restraints
Refine-IDTypeDev idealNumber
X-RAY DIFFRACTIONf_bond_d0.00514608
X-RAY DIFFRACTIONf_angle_d0.819876
X-RAY DIFFRACTIONf_chiral_restr0.0492261
X-RAY DIFFRACTIONf_plane_restr0.0042563
X-RAY DIFFRACTIONf_dihedral_angle_d13.7078733
Refine LS restraints NCS
Ens-IDDom-IDAuth asym-IDNumberRefine-IDRmsType
11G2078X-RAY DIFFRACTION8.741TORSIONAL
12H2078X-RAY DIFFRACTION8.741TORSIONAL
21L1997X-RAY DIFFRACTION8.741TORSIONAL
22I1997X-RAY DIFFRACTION8.741TORSIONAL
31B1421X-RAY DIFFRACTION8.741TORSIONAL
32F1421X-RAY DIFFRACTION8.741TORSIONAL
LS refinement shell

Refine-ID: X-RAY DIFFRACTION / Rfactor Rfree error: 0 / Total num. of bins used: 18

Resolution (Å)Rfactor RfreeNum. reflection RfreeRfactor RworkNum. reflection RworkNum. reflection all% reflection obs (%)
2.9347-2.99110.4116600.37191325138547
2.9911-3.05220.41121160.35731980209671
3.0522-3.11850.37991330.34612282241583
3.1185-3.1910.35791390.34782628276794
3.191-3.27080.37051300.3312762289298
3.2708-3.35920.33181330.30832766289999
3.3592-3.4580.31971400.29542773291399
3.458-3.56960.35561540.298727792933100
3.5696-3.69710.2511320.287727712903100
3.6971-3.8450.31271320.27628372969100
3.845-4.01990.2921790.261327432922100
4.0199-4.23160.27831550.223727632918100
4.2316-4.49650.30891370.205927902927100
4.4965-4.84320.24231570.19192795295299
4.8432-5.32970.26721840.188727502934100
5.3297-6.0990.22691560.20562791294799
6.099-7.67650.26761270.2042846297399
7.6765-42.22910.18321390.15362705284494
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)
11.262-1.23661.88290.9729-1.14582.8262-0.07150.2831-0.06330.18270.12680.3764-0.5018-0.3007-0.00020.8289-0.0220.07550.9484-0.0770.803811.4442-40.806313.0931
25.3453-1.085-0.61022.65090.74754.53930.17280.2408-0.1506-0.4045-0.29280.0709-0.6485-0.1793-00.8453-0.00030.01680.55890.01380.901810.5724-10.4364-35.0111
3-0.36070.095-0.8191.2787-1.15922.6958-0.0391-0.1930.11980.2576-0.0482-0.1739-0.2293-0.2074-00.7409-0.0706-0.05681.04740.14220.883213.0281-26.6209-6.3244
40.0511-0.1359-0.11760.64650.07020.5824-0.0814-0.1168-0.72060.26650.5263-0.3382-0.2985-0.27130.27380.42291.27410.6621.7893-0.31951.274510.2363-57.386736.0271
50.01340.0106-0.00120.03710.01330.02360.89540.6773-0.59590.8642-0.0830.9593-0.8255-0.27560.00131.2381-0.41950.17741.4441-0.04791.14449.0197-58.370226.0673
62.9291-0.58790.61910.7365-1.02211.4549-0.1937-0.8673-1.1735-0.90470.71721.5222-2.3983-1.26690.13491.12490.17450.07120.5903-0.04770.723716.3754-48.352826.9603
70.2532-0.3693-0.04090.5142-0.10440.17120.1463-1.26110.0681.0213-0.8206-0.1539-0.30810.33960.00221.2266-0.1067-0.01971.0585-0.05460.772219.0058-56.315839.6047
83.4979-1.06120.46082.0589-0.97330.90060.36521.32310.1241-0.7703-0.7401-0.06240.71111.6959-0.00930.92-0.00430.03361.0914-0.12690.763419.8119-45.18961.9303
91.942-0.12820.99070.03940.00310.83210.01740.17790.0521-0.7539-0.1376-0.14481.1893-0.7531-0.00010.98090.0608-0.03361.0276-0.11260.603515.2971-54.15759.3536
102.1606-0.21521.24030.1786-0.35771.0392-0.998-1.6613-0.34750.40450.6621-0.3644-0.9079-0.6808-0.01571.1144-0.1283-0.13150.7613-0.03420.870418.5347-65.452337.8648
110.25740.20960.38520.1680.30640.6078-0.6536-0.6681.77581.5423-0.1086-1.8032-1.38072.3058-0.07761.2444-0.1495-0.22150.8623-0.03690.921527.3804-57.609637.8437
121.2978-0.8835-0.35360.84990.03940.2681-0.0013-0.0644-1.51131.3915-0.0384-0.81050.44971.3132-0.00221.123-0.0862-0.1671.120.02071.031528.2577-70.823239.1537
131.81050.67350.34355.35770.54753.94350.107-0.6614-0.06441.4718-0.2203-0.6585-0.1073-0.0395-0.00011.3505-0.1562-0.20250.6863-0.02670.862632.729-29.511333.9676
140.62660.4581-0.13121.7166-0.81460.976-0.6687-0.6329-0.51121.73670.1498-1.14640.61850.1250.00051.7303-0.0569-0.44730.7254-0.00771.172834.4981-37.876637.2041
151.31282.0130.21742.9447-0.84761.53820.4467-0.1728-0.13121.2236-0.3649-0.6236-0.0230.30930.00081.3178-0.0121-0.22070.7131-0.05911.046332.4389-32.248431.0834
161.4591-0.506-1.41622.10580.91351.5244-0.3247-0.8384-1.3470.73320.9174-1.1367-0.17410.50720.26942.0835-0.4481-0.59190.29460.13881.457844.6753-18.050139.0391
170.36940.40630.26710.96110.56670.56270.1899-0.22690.42070.9189-0.5004-0.7425-0.5078-1.14990.00011.6736-0.0515-0.34221.1275-0.11612.105245.4226-1.706129.5684
181.19950.6588-0.34240.38-0.77822.0432-0.3906-0.36870.2610.62010.1435-0.7997-0.4984-2.6007-0.01161.78850.0621-0.14661.1464-0.08391.840142.2315-2.329529.5873
193.39741.4914-0.11983.87051.0285.16840.09570.689-0.2046-0.90660.0514-1.2-0.85440.11120.00020.9507-0.19820.31290.8769-0.07511.054436.5832-30.702610.6173
200.7182-0.1724-0.39450.1530.20380.17750.5160.131-0.11851.76-0.14-1.5358-0.55091.04230.00060.9321-0.0281-0.02390.7649-0.14221.175738.8684-35.583619.1295
210.20020.32550.46634.92211.94091.5307-0.32750.101-0.6933-1.6694-0.5492-1.3097-1.5743-0.5584-0.49031.4988-0.57980.61631.04680.01861.851747.1809-12.96766.0688
220.8770.2810.29240.24480.34470.4633-0.51090.05630.79710.9272-0.2368-1.0467-0.903-0.0647-0.55392.18450.0119-0.80990.0272-0.74422.570454.51844.889729.7459
238.47084.19455.74987.10194.4474.5243-1.62122.5268-0.006-0.78641.1216-1.9792-0.84162.0495-0.23531.671-0.26570.69430.4249-0.09382.921157.207-4.512517.933
240.1364-0.2367-0.02270.37660.03380.7363-0.07431.16671.5996-0.24311.0607-1.91320.70770.96790.02431.3178-0.01520.23011.0180.10083.203564.416-4.677524.1716
250.1590.07440.03440.05980.06670.06060.5109-1.1925-0.3864-1.1366-0.23410.1598-1.2054-0.5613-0.00071.8427-0.23740.7621.1838-0.0551.599643.9759-10.405312.6152
260.67650.907-0.19181.0342-0.29695.38030.5380.3345-1.67641.93980.1043-0.7638-0.20062.2875-0.09181.5057-0.1376-0.22430.8877-0.18062.733563.28332.133426.9364
273.45231.1954-0.10960.38650.0457-0.0472-1.85411.53670.57130.0329-0.0804-1.3342-0.32910.3717-0.70811.9207-0.39640.10650.9547-0.59732.809660.71315.309214.9705
282.13481.36941.08224.05371.32451.56970.17370.7188-1.00520.2177-0.168-0.08880.3870.228400.8406-0.10970.31451.5649-0.32321.2951-11.8499-24.05846.0219
290.1791-0.45750.43321.658-1.26010.977-0.23952.2074-0.834-0.42790.3611-0.0535-0.2360.7190.00181.63010.2953-0.32622.4163-1.0351.9119-22.6012-29.7383-14.6045
302.9502-0.22220.50291.26140.69870.3508-0.19570.8484-0.85210.3675-0.04850.3539-0.21350.3698-0.00151.0417-0.16070.25971.3835-0.11110.9896-10.2444-14.493811.4076
310.0457-0.0811-0.02380.07040.02130.0370.5772-0.4934-0.2512-1.2569-0.3352-1.79080.90490.58760.00141.8277-0.2286-0.54491.7960.19921.461621.512522.95137.5806
320.4454-0.29940.13250.28580.0066-0.0079-0.2599-0.48450.28240.11760.13370.316-0.53651.58830.00021.7348-0.3974-0.47391.35940.21941.054416.632816.767646.2885
33-0.02340.08020.00081.6763-1.58871.24390.0489-0.72480.14320.0321-0.88180.0161.1396-2.4962-0.01241.1371-0.2467-0.03231.71910.08380.8677-9.16938.287723.0362
340.7438-1.03341.17262.6669-1.99321.4163-0.3027-0.00190.0960.8201-0.1096-0.20580.01940.7119-0.24061.392-0.3078-0.29321.50.19030.84660.291216.281524.5627
352.8425-0.06880.66150.17960.12461.3345-0.8274-0.76111.4437-0.1564-0.1589-0.2588-1.37180.3117-0.11582.4956-0.4437-0.90121.2240.32681.438614.872329.218952.47
361.8334-0.7322-0.32180.40150.08280.0870.7087-0.44610.8726-0.1676-0.0965-1.11930.92631.52560.02972.7229-0.0654-0.74031.5535-0.19411.445112.371936.779459.9268
373.7293-0.07431.01483.631-0.54653.2289-0.03940.2303-0.2210.0252-0.1511-0.6701-0.07760.4529-0.00020.9582-0.1603-0.12810.86410.11430.87926.9526-5.769856.4283
381.01860.4310.5251.9976-0.54721.63730.36040.13010.8848-0.4007-0.9943-0.3007-0.30680.37310.00111.0797-0.112-0.22670.97650.18331.0168.48591.65760.021
390.55730.5819-0.1130.5377-0.96881.298-0.13240.2690.52540.16050.109-0.1529-0.2345-0.4646-0.00031.0245-0.1395-0.13670.96990.16950.94694.6722-5.759760.8239
400.93390.40480.37420.37410.13170.184-0.29680.665-0.55060.0745-0.3468-0.5313-0.08930.04770.0010.9517-0.0009-0.01921.0120.1370.99594.0317-3.447449.0979
410.3655-0.0158-0.20670.3863-0.40460.46570.2583-0.6299-0.98181.3746-0.1363-0.7580.9439-0.33660.00030.97930.0806-0.04470.7970.11051.4009-0.8791-29.354169.9302
420.6903-0.4587-0.13830.65560.50880.2985-0.47631.2183-0.399-0.17730.50090.34790.36851.16350.00151.1349-0.04080.05680.9261-0.16191.5073-4.7058-33.425359.5674
430.41120.47910.31931.4049-0.06910.284-0.110.4993-0.88290.96290.187-0.13432.36080.501-0.00031.2103-0.0172-0.25671.018-0.16921.4119-8.3441-28.436760.0753
440.47490.6914-0.54560.5221-0.53231.0287-0.32580.7252-0.4997-0.01420.5347-1.08220.91981.42980.00281.34190.2811-0.10561.367-0.43111.782-2.2105-37.986557.189
454.56672.05730.77954.3388-2.66283.1887-0.15560.70020.1998-0.57180.18310.5835-0.1098-0.57760.00021.0655-0.0949-0.2481.29540.15070.8241-11.2815-3.656543.6503
460.41810.21850.49090.4044-0.32610.80970.95461.99390.21570.9166-0.75540.99230.858-0.0243-0.01221.0069-0.3296-0.17381.95870.01221.1308-22.2252-21.292145.9952
470.2236-0.1493-0.09830.51310.16050.0679-0.32311.3637-1.90470.84330.1472-1.28461.78871.0220.0011.7196-0.0661-0.10431.1765-0.15771.8238-11.0787-41.639565.6718
481.18420.05770.79291.3321-0.50650.53950.11990.028-0.6033-0.1463-0.32110.75730.1245-1.7946-0.00131.11170.028-0.1791.2634-0.02531.58-22.966-33.326562.3509
490.1554-0.4160.23141.4289-0.70680.44210.20411.1102-0.6710.0513-0.77320.14881.16350.4451-0.0091.1572-0.1076-0.17911.1939-0.16781.3672-17.3203-26.058455.4158
502.29350.8848-1.70071.18320.14591.72850.3516-0.1076-1.17070.6301-0.01630.84091.1702-0.457-0.00011.5568-0.1624-0.16760.88420.03381.6522-22.1149-40.296366.048
Refinement TLS group
IDRefine-IDRefine TLS-IDSelection detailsAuth asym-IDAuth seq-ID
1X-RAY DIFFRACTION1chain 'A' and (resid 8 through 57 )A8 - 57
2X-RAY DIFFRACTION2chain 'A' and (resid 58 through 249 )A58 - 249
3X-RAY DIFFRACTION3chain 'A' and (resid 250 through 326 )A250 - 326
4X-RAY DIFFRACTION4chain 'B' and (resid 4 through 8 )B4 - 8
5X-RAY DIFFRACTION5chain 'B' and (resid 9 through 13 )B9 - 13
6X-RAY DIFFRACTION6chain 'B' and (resid 14 through 22 )B14 - 22
7X-RAY DIFFRACTION7chain 'B' and (resid 23 through 30 )B23 - 30
8X-RAY DIFFRACTION8chain 'B' and (resid 31 through 81 )B31 - 81
9X-RAY DIFFRACTION9chain 'B' and (resid 82 through 132 )B82 - 132
10X-RAY DIFFRACTION10chain 'B' and (resid 133 through 145 )B133 - 145
11X-RAY DIFFRACTION11chain 'B' and (resid 146 through 153 )B146 - 153
12X-RAY DIFFRACTION12chain 'B' and (resid 154 through 170 )B154 - 170
13X-RAY DIFFRACTION13chain 'H' and (resid 1 through 57 )H1 - 57
14X-RAY DIFFRACTION14chain 'H' and (resid 58 through 75 )H58 - 75
15X-RAY DIFFRACTION15chain 'H' and (resid 76 through 115 )H76 - 115
16X-RAY DIFFRACTION16chain 'H' and (resid 116 through 131 )H116 - 131
17X-RAY DIFFRACTION17chain 'H' and (resid 132 through 169 )H132 - 169
18X-RAY DIFFRACTION18chain 'H' and (resid 170 through 227 )H170 - 227
19X-RAY DIFFRACTION19chain 'L' and (resid 1 through 84 )L1 - 84
20X-RAY DIFFRACTION20chain 'L' and (resid 85 through 102 )L85 - 102
21X-RAY DIFFRACTION21chain 'L' and (resid 103 through 113 )L103 - 113
22X-RAY DIFFRACTION22chain 'L' and (resid 114 through 128 )L114 - 128
23X-RAY DIFFRACTION23chain 'L' and (resid 129 through 150 )L129 - 150
24X-RAY DIFFRACTION24chain 'L' and (resid 151 through 163 )L151 - 163
25X-RAY DIFFRACTION25chain 'L' and (resid 164 through 174 )L164 - 174
26X-RAY DIFFRACTION26chain 'L' and (resid 175 through 197 )L175 - 197
27X-RAY DIFFRACTION27chain 'L' and (resid 198 through 214 )L198 - 214
28X-RAY DIFFRACTION28chain 'E' and (resid 8 through 195 )E8 - 195
29X-RAY DIFFRACTION29chain 'E' and (resid 196 through 228 )E196 - 228
30X-RAY DIFFRACTION30chain 'E' and (resid 229 through 326 )E229 - 326
31X-RAY DIFFRACTION31chain 'F' and (resid 4 through 13 )F4 - 13
32X-RAY DIFFRACTION32chain 'F' and (resid 14 through 37 )F14 - 37
33X-RAY DIFFRACTION33chain 'F' and (resid 38 through 81 )F38 - 81
34X-RAY DIFFRACTION34chain 'F' and (resid 82 through 126 )F82 - 126
35X-RAY DIFFRACTION35chain 'F' and (resid 127 through 158 )F127 - 158
36X-RAY DIFFRACTION36chain 'F' and (resid 159 through 165 )F159 - 165
37X-RAY DIFFRACTION37chain 'G' and (resid 1 through 58 )G1 - 58
38X-RAY DIFFRACTION38chain 'G' and (resid 59 through 76 )G59 - 76
39X-RAY DIFFRACTION39chain 'G' and (resid 77 through 100 )G77 - 100
40X-RAY DIFFRACTION40chain 'G' and (resid 101 through 123 )G101 - 123
41X-RAY DIFFRACTION41chain 'G' and (resid 124 through 136 )G124 - 136
42X-RAY DIFFRACTION42chain 'G' and (resid 137 through 169 )G137 - 169
43X-RAY DIFFRACTION43chain 'G' and (resid 170 through 187 )G170 - 187
44X-RAY DIFFRACTION44chain 'G' and (resid 188 through 227 )G188 - 227
45X-RAY DIFFRACTION45chain 'I' and (resid 1 through 101 )I1 - 101
46X-RAY DIFFRACTION46chain 'I' and (resid 102 through 113 )I102 - 113
47X-RAY DIFFRACTION47chain 'I' and (resid 114 through 128 )I114 - 128
48X-RAY DIFFRACTION48chain 'I' and (resid 129 through 155 )I129 - 155
49X-RAY DIFFRACTION49chain 'I' and (resid 156 through 174 )I156 - 174
50X-RAY DIFFRACTION50chain 'I' and (resid 175 through 214 )I175 - 214

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