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- PDB-4avt: Structure of CPHPC bound to Serum Amyloid P Component -

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ID or keywords:

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Basic information

Entry
Database: PDB / ID: 4avt
TitleStructure of CPHPC bound to Serum Amyloid P Component
ComponentsSERUM AMYLOID P-COMPONENT
KeywordsSUGAR BINDING PROTEIN / LECTIN / METAL-BINDING
Function / homology
Function and homology information


negative regulation by host of viral exo-alpha-sialidase activity / negative regulation by host of viral glycoprotein metabolic process / negative regulation of exo-alpha-sialidase activity / negative regulation of glycoprotein metabolic process / complement component C1q complex binding / negative regulation of viral process / negative regulation of wound healing / negative regulation of monocyte differentiation / negative regulation of viral entry into host cell / virion binding ...negative regulation by host of viral exo-alpha-sialidase activity / negative regulation by host of viral glycoprotein metabolic process / negative regulation of exo-alpha-sialidase activity / negative regulation of glycoprotein metabolic process / complement component C1q complex binding / negative regulation of viral process / negative regulation of wound healing / negative regulation of monocyte differentiation / negative regulation of viral entry into host cell / virion binding / negative regulation of acute inflammatory response / chaperone-mediated protein complex assembly / acute-phase response / unfolded protein binding / protein folding / carbohydrate binding / collagen-containing extracellular matrix / blood microparticle / Amyloid fiber formation / innate immune response / calcium ion binding / extracellular space / extracellular exosome / extracellular region / identical protein binding / nucleus
Similarity search - Function
Pentaxin, conserved site / Pentraxin domain signature. / Pentaxin family / Pentraxin / C-reactive protein / pentaxin family / Pentraxin-related / Pentraxin (PTX) domain profile. / Jelly Rolls - #200 / Concanavalin A-like lectin/glucanase domain superfamily / Jelly Rolls / Sandwich / Mainly Beta
Similarity search - Domain/homology
Chem-GHE / Serum amyloid P-component
Similarity search - Component
Biological speciesHOMO SAPIENS (human)
MethodX-RAY DIFFRACTION / SYNCHROTRON / MOLECULAR REPLACEMENT / Resolution: 3.2 Å
AuthorsKolstoe, S.E. / Purvis, A. / Wood, S.P.
CitationJournal: Acta Crystallogr.,Sect.D / Year: 2014
Title: Interaction of Serum Amyloid P Component with Hexanoyl Bis(D-Proline) (Cphpc)
Authors: Kolstoe, S.E. / Jenvey, M.C. / Purvis, A. / Light, M.E. / Thompson, D. / Hughes, P. / Pepys, M.B. / Wood, S.P.
History
DepositionMay 29, 2012Deposition site: PDBE / Processing site: PDBE
Revision 1.0Jun 19, 2013Provider: repository / Type: Initial release
Revision 1.1Aug 6, 2014Group: Database references
Revision 1.2Oct 22, 2014Group: Database references
Revision 1.3Jul 29, 2020Group: Data collection / Derived calculations ...Data collection / Derived calculations / Other / Structure summary
Category: chem_comp / entity ...chem_comp / entity / pdbx_chem_comp_identifier / pdbx_database_status / pdbx_entity_nonpoly / pdbx_struct_conn_angle / struct_conn / struct_site / struct_site_gen
Item: _chem_comp.name / _chem_comp.type ..._chem_comp.name / _chem_comp.type / _entity.pdbx_description / _pdbx_database_status.status_code_sf / _pdbx_entity_nonpoly.name / _pdbx_struct_conn_angle.ptnr1_auth_asym_id / _pdbx_struct_conn_angle.ptnr1_auth_comp_id / _pdbx_struct_conn_angle.ptnr1_auth_seq_id / _pdbx_struct_conn_angle.ptnr1_label_asym_id / _pdbx_struct_conn_angle.ptnr1_label_atom_id / _pdbx_struct_conn_angle.ptnr1_label_comp_id / _pdbx_struct_conn_angle.ptnr1_label_seq_id / _pdbx_struct_conn_angle.ptnr3_auth_asym_id / _pdbx_struct_conn_angle.ptnr3_auth_comp_id / _pdbx_struct_conn_angle.ptnr3_auth_seq_id / _pdbx_struct_conn_angle.ptnr3_label_asym_id / _pdbx_struct_conn_angle.ptnr3_label_atom_id / _pdbx_struct_conn_angle.ptnr3_label_comp_id / _pdbx_struct_conn_angle.ptnr3_label_seq_id / _pdbx_struct_conn_angle.value / _struct_conn.conn_type_id / _struct_conn.id / _struct_conn.pdbx_dist_value / _struct_conn.pdbx_leaving_atom_flag / _struct_conn.pdbx_role / _struct_conn.ptnr1_auth_asym_id / _struct_conn.ptnr1_auth_comp_id / _struct_conn.ptnr1_auth_seq_id / _struct_conn.ptnr1_label_asym_id / _struct_conn.ptnr1_label_atom_id / _struct_conn.ptnr1_label_comp_id / _struct_conn.ptnr1_label_seq_id / _struct_conn.ptnr2_auth_asym_id / _struct_conn.ptnr2_auth_comp_id / _struct_conn.ptnr2_auth_seq_id / _struct_conn.ptnr2_label_asym_id / _struct_conn.ptnr2_label_atom_id / _struct_conn.ptnr2_label_comp_id / _struct_conn.ptnr2_label_seq_id
Description: Carbohydrate remediation / Provider: repository / Type: Remediation
Revision 1.4Dec 20, 2023Group: Data collection / Database references ...Data collection / Database references / Refinement description / Structure summary
Category: chem_comp / chem_comp_atom ...chem_comp / chem_comp_atom / chem_comp_bond / database_2 / pdbx_initial_refinement_model
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: SERUM AMYLOID P-COMPONENT
B: SERUM AMYLOID P-COMPONENT
C: SERUM AMYLOID P-COMPONENT
D: SERUM AMYLOID P-COMPONENT
E: SERUM AMYLOID P-COMPONENT
F: SERUM AMYLOID P-COMPONENT
G: SERUM AMYLOID P-COMPONENT
H: SERUM AMYLOID P-COMPONENT
I: SERUM AMYLOID P-COMPONENT
J: SERUM AMYLOID P-COMPONENT
hetero molecules


Theoretical massNumber of molelcules
Total (without water)237,54045
Polymers232,82510
Non-polymers4,71535
Water00
1
A: SERUM AMYLOID P-COMPONENT
C: SERUM AMYLOID P-COMPONENT
E: SERUM AMYLOID P-COMPONENT
G: SERUM AMYLOID P-COMPONENT
I: SERUM AMYLOID P-COMPONENT
hetero molecules


Theoretical massNumber of molelcules
Total (without water)118,94023
Polymers116,4125
Non-polymers2,52818
Water0
TypeNameSymmetry operationNumber
identity operation1_555x,y,z1
Buried area9660 Å2
ΔGint-131.8 kcal/mol
Surface area38290 Å2
MethodPISA
2
B: SERUM AMYLOID P-COMPONENT
D: SERUM AMYLOID P-COMPONENT
F: SERUM AMYLOID P-COMPONENT
H: SERUM AMYLOID P-COMPONENT
J: SERUM AMYLOID P-COMPONENT
hetero molecules


Theoretical massNumber of molelcules
Total (without water)118,60022
Polymers116,4125
Non-polymers2,18817
Water0
TypeNameSymmetry operationNumber
identity operation1_555x,y,z1
Buried area9690 Å2
ΔGint-132.6 kcal/mol
Surface area38270 Å2
MethodPISA
Unit cell
Length a, b, c (Å)230.864, 230.864, 281.393
Angle α, β, γ (deg.)90.00, 90.00, 90.00
Int Tables number96
Space group name H-MP43212
Noncrystallographic symmetry (NCS)NCS domain:
IDEns-ID
11
21
31
41
51
61
71
81
91
101

NCS domain segments:
Dom-IDComponent-IDEns-IDSelection details
111CHAIN A AND (RESSEQ 1:204 ) AND (NOT ELEMENT H)
211CHAIN B AND (RESSEQ 1:204 ) AND (NOT ELEMENT H)
311CHAIN C AND (RESSEQ 1:204 ) AND (NOT ELEMENT H)
411CHAIN D AND (RESSEQ 1:204 ) AND (NOT ELEMENT H)
511CHAIN E AND (RESSEQ 1:204 ) AND (NOT ELEMENT H)
611CHAIN F AND (RESSEQ 1:204 ) AND (NOT ELEMENT H)
711CHAIN G AND (RESSEQ 1:204 ) AND (NOT ELEMENT H)
811CHAIN H AND (RESSEQ 1:204 ) AND (NOT ELEMENT H)
911CHAIN I AND (RESSEQ 1:204 ) AND (NOT ELEMENT H)
1011CHAIN J AND (RESSEQ 1:204 ) AND (NOT ELEMENT H)

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Components

#1: Protein
SERUM AMYLOID P-COMPONENT / SAP / 9.5S ALPHA-1-GLYCOPROTEIN


Mass: 23282.455 Da / Num. of mol.: 10 / Source method: isolated from a natural source / Source: (natural) HOMO SAPIENS (human) / Tissue: SERUM / References: UniProt: P02743
#2: Chemical
ChemComp-CA / CALCIUM ION


Mass: 40.078 Da / Num. of mol.: 20 / Source method: obtained synthetically / Formula: Ca
#3: 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.: 10
Source method: isolated from a genetically manipulated source
Formula: C8H15NO6
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
#4: Chemical
ChemComp-GHE / (2R)-1-[6-[(2R)-2-carboxypyrrolidin-1-yl]-6-oxidanylidene-hexanoyl]pyrrolidine-2-carboxylic acid


Mass: 340.372 Da / Num. of mol.: 5 / Source method: obtained synthetically / Formula: C16H24N2O6

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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: 7.5 Å3/Da / Density % sol: 83.61 % / Description: NONE
Crystal growpH: 7.6 / Details: 60MM TRIS-HCL, 80MM NACL, 15% PEG550 MME, pH 7.6

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Data collection

DiffractionMean temperature: 100 K
Diffraction sourceSource: SYNCHROTRON / Site: ESRF / Beamline: ID14-3 / Wavelength: 0.98
DetectorType: ADSC CCD / Detector: CCD
RadiationProtocol: SINGLE WAVELENGTH / Monochromatic (M) / Laue (L): M / Scattering type: x-ray
Radiation wavelengthWavelength: 0.98 Å / Relative weight: 1
ReflectionResolution: 3.2→24.92 Å / Num. obs: 122013 / % possible obs: 98 % / Observed criterion σ(I): 2 / Redundancy: 3.9 % / Biso Wilson estimate: 81.83 Å2 / Rmerge(I) obs: 0.09 / Net I/σ(I): 11.8
Reflection shellResolution: 3.2→3.37 Å / Redundancy: 3.3 % / Rmerge(I) obs: 0.65 / Mean I/σ(I) obs: 2 / % possible all: 95.8

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Processing

Software
NameVersionClassification
PHENIX(PHENIX.REFINE: 1.7.3_928)refinement
MOLREPphasing
RefinementMethod to determine structure: MOLECULAR REPLACEMENT
Starting model: PDB ENTRY 1SAC
Resolution: 3.2→24.942 Å / SU ML: 0.37 / σ(F): 1.35 / Phase error: 20.58 / Stereochemistry target values: ML
RfactorNum. reflection% reflection
Rfree0.1974 1999 1.6 %
Rwork0.1889 --
obs0.189 121859 97.71 %
Solvent computationShrinkage radii: 0.86 Å / VDW probe radii: 1.1 Å / Solvent model: FLAT BULK SOLVENT MODEL / Bsol: 34.492 Å2 / ksol: 0.293 e/Å3
Displacement parameters
Baniso -1Baniso -2Baniso -3
1-12.6959 Å20 Å20 Å2
2--12.6959 Å20 Å2
3----25.3919 Å2
Refinement stepCycle: LAST / Resolution: 3.2→24.942 Å
ProteinNucleic acidLigandSolventTotal
Num. atoms16490 0 280 0 16770
Refine LS restraints
Refine-IDTypeDev idealNumber
X-RAY DIFFRACTIONf_bond_d0.01517349
X-RAY DIFFRACTIONf_angle_d1.18623481
X-RAY DIFFRACTIONf_dihedral_angle_d15.6776430
X-RAY DIFFRACTIONf_chiral_restr0.0652531
X-RAY DIFFRACTIONf_plane_restr0.0042983
Refine LS restraints NCS
Ens-IDDom-IDAuth asym-IDNumberRefine-IDTypeRms dev position (Å)
11A1649X-RAY DIFFRACTIONPOSITIONAL
12B1649X-RAY DIFFRACTIONPOSITIONAL0.026
13C1637X-RAY DIFFRACTIONPOSITIONAL0.032
14D1649X-RAY DIFFRACTIONPOSITIONAL0.065
15E1649X-RAY DIFFRACTIONPOSITIONAL0.062
16F1649X-RAY DIFFRACTIONPOSITIONAL0.031
17G1649X-RAY DIFFRACTIONPOSITIONAL0.031
18H1649X-RAY DIFFRACTIONPOSITIONAL0.049
19I1649X-RAY DIFFRACTIONPOSITIONAL0.033
110J1649X-RAY DIFFRACTIONPOSITIONAL0.035
LS refinement shell
Resolution (Å)Rfactor RfreeNum. reflection RfreeRfactor RworkNum. reflection RworkRefine-ID% reflection obs (%)
3.2-3.27990.34871350.36088088X-RAY DIFFRACTION94
3.2799-3.36840.35491390.3238351X-RAY DIFFRACTION97
3.3684-3.46720.32261410.29038482X-RAY DIFFRACTION98
3.4672-3.57880.25331430.26018531X-RAY DIFFRACTION98
3.5788-3.70630.26141420.24698590X-RAY DIFFRACTION99
3.7063-3.85420.21221440.2218608X-RAY DIFFRACTION99
3.8542-4.0290.23121430.22328605X-RAY DIFFRACTION99
4.029-4.24040.22291440.20028587X-RAY DIFFRACTION99
4.2404-4.50460.15181440.15798614X-RAY DIFFRACTION99
4.5046-4.85010.13761430.1388621X-RAY DIFFRACTION98
4.8501-5.33380.14261450.12888627X-RAY DIFFRACTION98
5.3338-6.09580.16061440.15118662X-RAY DIFFRACTION98
6.0958-7.64320.1861450.16298725X-RAY DIFFRACTION98
7.6432-24.94290.15921470.15928769X-RAY DIFFRACTION95
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)
11.5692-0.1885-2.75777.9938-4.62249.5167-0.2229-0.3336-0.06260.5089-0.50120.09480.4152-0.08180.63640.9932-0.53940.03610.91230.07390.849248.3702188.7618111.7967
26.72833.7916-0.85537.5999-1.39980.24920.5646-0.57510.68150.6704-0.29440.63830.3163-1.8608-0.36230.7284-0.46090.12931.24590.02980.972341.7395196.7297115.8649
36.40770.6073-1.51613.53650.74295.01060.1276-1.0288-0.60470.8292-0.36111.03090.4439-1.19040.46270.6837-0.32550.11340.9830.07250.651652.1853199.5841125.0508
46.60960.6302-0.80236.6961.45094.7379-0.05290.00110.79940.2405-0.23830.48170.5249-1.52280.22260.4236-0.2128-0.03390.81560.07450.7150.3565205.5036114.0367
59.2036-1.7903-5.37599.49763.55864.0190.5915-0.91960.7761-0.2697-0.1728-0.1580.00240.407-0.43060.7864-0.2672-0.08070.91240.05830.662659.0406208.2147114.2675
64.7411-4.4409-6.14778.33644.12159.23940.13660.4198-1.5742-0.4408-0.97460.9315-0.768-0.43320.73230.5605-0.1265-0.01270.6598-0.03980.5860.0898210.2943116.8933
73.212-0.6587-2.31648.77715.82476.8984-0.0443-0.72940.09450.82590.01070.33820.9127-0.04870.10470.6206-0.2173-0.00680.89980.09590.513760.7302202.7727121.4755
89.5566-3.2302-2.53468.27181.36315.00850.3289-0.95320.26620.5912-0.27010.3210.1619-0.6556-0.11090.5718-0.20510.07710.7818-0.00620.550558.8219207.8732125.2372
90.18820.717-0.59226.8089-2.96875.43510.3884-0.52581.11290.166-0.41021.21510.3882-1.5125-0.03180.6247-0.31050.04111.2383-0.06521.038842.423204.1184113.1424
102.584-0.12383.43083.52821.66675.0027-0.0137-0.2475-0.13720.34490.16090.25051.0996-0.2678-0.16880.7792-0.38280.05830.93640.10120.64557.7794194.2627122.9118
110.70521.5419-0.60094.83871.12716.1831-0.1374-0.5794-0.13520.6905-0.83140.85260.5363-1.47560.65660.9159-0.56720.21721.08560.07440.868145.9897190.3348119.8835
129.94471.81112.04669.4636-1.23592.76330.27160.0317-0.4920.3155-0.44760.15351.39370.67020.27810.9287-0.25650.10820.83230.09370.683855.4098184.491110.5485
137.97550.4312.46615.7196-2.14235.52530.69980.49810.69880.102-0.64620.86970.0795-0.117-0.03460.61780.15020.05051.0001-0.11350.85445.2957239.5045105.2897
141.5307-1.0336-0.47067.46551.19343.1958-0.4127-2.574-0.52330.5379-0.1261.1171-0.0214-2.76960.38270.529-0.08080.21231.4201-0.07191.035738.2486231.554108.6175
153.54623.62481.45465.40150.31043.65830.58570.28510.61770.8462-0.22561.3188-0.7711-1.7411-0.19130.35470.04760.08011.1905-0.03140.876735.9908228.948594.8382
165.90390.5785-4.37997.74470.59227.21520.0344-0.457-0.04260.5624-0.24990.60950.7295-1.16250.1490.553-0.05130.08651.00860.12630.541444.2832222.8229102.1361
175.86811.0909-0.64644.8642.0082.4729-0.06410.5702-0.16490.03710.25470.44170.8783-0.7932-0.06080.6331-0.1978-0.08820.83410.06930.589948.6744220.191994.6226
188.19434.8255-4.43418.046-5.23284.28961.8846-0.5719-0.96761.1707-1.3666-0.0922-0.884-0.6899-0.60380.6523-0.17660.03370.85650.15260.794646.9861218.1792.3054
199.53895.86931.4446.67382.02581.1623-0.77460.37560.0393-0.3970.34080.5609-0.4746-1.23770.36890.4041-0.0467-0.09021.27230.07020.724143.5233225.776689.4432
206.2658-0.4583-1.77265.0363-0.81791.3578-0.1969-0.263-0.8373-0.1026-0.43770.25130.1591-1.24110.53690.4113-0.2519-0.02851.15630.0590.716139.2752220.725388.9766
213.6441-3.20642.23598.5584-0.77245.7195-0.16810.6826-0.54560.6879-0.42930.58490.3781-1.14130.57080.6955-0.15730.1691.35010.03490.874740.8374224.122109.3601
221.79451.46193.10515.29660.17116.1888-0.3029-0.12010.5378-0.03490.3080.9929-0.3547-1.2015-0.070.55020.08360.04621.2550.03180.861740.829234.284191.329
234.9631.78473.26576.80493.99893.20780.4966-1.37230.90480.5077-0.80991.39080.184-2.16040.34730.57170.09530.16421.3645-0.06770.984237.165238.052102.9809
243.0345-1.997-2.53767.92261.52082.13740.06610.98361.0566-0.4826-0.4319-0.1783-0.06160.07360.44110.80230.13680.03121.08310.02851.012450.1313243.8206100.0642
258.57121.2187-3.12317.02731.71255.77670.40750.0657-0.63450.5178-0.08760.53380.5555-0.0677-0.40791.1195-0.0833-0.14320.45170.01140.59572.101174.971381.0364
264.4542-4.04131.01324.49860.95485.8171-0.04880.4542-0.6621-0.1826-0.15290.32441.2976-1.49740.41441.1484-0.344-0.13220.74820.00050.761661.5001175.413377.6691
275.06625.4283-2.13596.3567-0.574.00020.34150.6462-1.18780.3257-0.04480.38281.6094-0.6449-0.12811.0158-0.3426-0.13120.61390.10070.699958.0143175.960291.4233
286.54580.38612.78685.82253.0322.9568-0.04320.2154-0.0658-0.3947-0.34070.49441.1171-0.79360.28790.8451-0.4092-0.06990.58320.03930.463859.4615185.99183.8816
292.536-1.4052-0.34726.23941.38264.19090.0572-0.92890.41080.0986-0.2864-0.0978-0.4479-0.4810.23530.651-0.15360.03060.63910.07910.548460.6304191.152691.2807
308.33062.85586.71514.70520.92579.11710.56030.1134-0.32550.30680.107-0.24690.8194-0.4064-0.72940.795-0.2302-0.07690.80210.01830.610158.0002191.414693.5833
314.0322-0.338-0.65110.05070.24342.44390.2193-1.0423-0.70530.0219-0.2590.12711.4265-0.31630.09730.9908-0.47960.01220.67560.14910.713761.001183.691896.6389
324.29812.20962.02845.99480.50250.8473-0.1839-0.42040.52180.1711-0.28970.56721.4454-0.91310.32120.8186-0.5357-0.00480.91110.05110.624754.4158184.199797.0748
338.9343-2.10960.77660.5745-0.82623.14330.5576-0.01540.19540.394-0.91540.30740.39570.0720.33380.8202-0.2872-0.09040.4956-0.01980.5657.5032182.355576.4812
343.7386-0.9241-1.02641.76110.17445.64520.1934-0.5068-0.79890.3857-0.0679-0.02631.2456-0.0508-0.09411.2276-0.257-0.09030.6140.06690.6865.1963175.77394.9583
357.65270.1805-7.03223.5281-2.76238.00050.18790.7745-1.38860.1421-0.12030.0111.2782-0.7540.08211.2796-0.3343-0.10660.4980.0090.762765.368170.232783.4425
361.92291.68141.28542.61241.96981.52350.8721-0.4266-0.27770.5604-0.4702-1.43720.6419-0.0246-0.56871.3-0.0069-0.13820.61790.03270.820178.5514175.538386.2655
373.0316-3.10270.73923.483-0.31417.0853-0.20020.33620.2587-0.165-0.50410.0734-0.16320.21730.68930.5188-0.1935-0.12741.11870.09470.96938.2698213.633174.0199
384.3282-0.565-3.57295.2584-2.35184.4981-0.46540.4105-0.777-0.4944-0.29760.13031.7789-2.94440.47110.6774-0.384-0.13131.06210.02680.899939.1883203.374769.7953
393.5420.134-2.69389.27485.12428.9273-0.40950.6460.0676-1.06910.44541.22930.0913-0.33250.12620.5341-0.1925-0.19840.72610.22110.737648.6382208.836960.7197
405.59580.5821.02575.59222.38493.1777-1.2253-1.049-0.2361.47071.4669-0.25210.1796-1.8795-0.0824-0.6352-1.799-0.0756-0.34960.24610.70451.4791203.183271.6577
412.9335-2.2314-1.9372.91022.38055.8497-0.25630.3124-0.11950.24340.4708-0.0688-0.06940.6065-0.10150.6498-0.1987-0.02440.87980.13360.745859.5514207.371771.5151
427.51855.6383.89635.12724.29277.61780.00340.01040.97681.4245-0.49950.66641.1935-0.17710.72250.6048-0.2169-0.10830.55670.15370.566761.7695206.673368.8788
434.1109-2.9601-3.17477.31885.55514.1732-0.05510.3132-0.0735-0.96650.22230.4286-0.6907-0.043-0.2040.71-0.2803-0.0790.64130.16480.52856.9369212.535364.3689
444.5028-1.34040.13810.5981-0.37842.6617-0.32830.7107-0.084-0.22840.5077-0.22290.642-0.4934-0.10010.5828-0.3078-0.04050.54970.10.494259.1888207.628360.5456
451.6333-2.5334-0.01723.9285-1.37053.5801-0.08860.45-0.5625-0.12970.3480.2530.6862-0.8716-0.18020.7536-0.3724-0.07850.94970.05920.807544.8695198.570272.4601
463.237-0.4131-2.21483.40550.13193.64270.1060.05360.3377-0.4278-0.0320.2218-0.2214-0.7237-0.03760.5412-0.3064-0.16270.79510.1430.83648.8506216.516762.9726
474.8733-2.7357-2.57781.49441.38113.1608-0.12310.2972-0.3968-0.2484-0.29370.82460.5091-1.10180.4190.5542-0.3816-0.20431.14590.12150.956237.7191210.965665.8844
488.3372-2.23343.26493.05962.06764.9031-0.1914-0.1676-0.3305-0.1512-0.1557-0.2903-1.125-0.26920.41880.8322-0.0903-0.12960.95360.06940.992440.2517221.599875.3928
497.0474-1.50824.26583.6082-1.18815.8101-0.34220.0292-0.32520.49630.172-0.64410.53110.31090.22940.57630.19980.1410.77940.0250.6279108.8725193.202683.8664
508.2009-0.26090.99430.9627-2.11774.40510.08380.6676-0.6434-0.54850.1485-1.2087-0.2032-0.0888-0.28920.7260.27230.1380.76220.03370.5126106.3129191.569773.1601
514.92382.77830.03098.65176.09868.5936-0.21810.2969-0.77790.1906-0.0796-0.02031.62181.12890.44150.80230.22180.00320.61480.14980.657596.6727182.20777.7357
529.3985-2.9937-3.94274.51983.61084.98-0.13650.98410.0971-0.6188-0.08610.0349-0.0258-0.32120.26110.71860.07510.020.60180.14730.420694.335194.336675.1183
538.5371-1.4367-1.06827.12673.77636.96490.03690.58511.0687-0.5340.09110.5129-0.2923-0.7449-0.13740.7646-0.0861-0.05760.61920.12620.615686.8563193.834180.2415
546.7993-0.59080.31337.93474.01912.73330.28340.2292-0.4916-0.55210.55470.5778-1.19051.3408-0.94490.71180.0282-0.05490.72970.06220.5984.3082191.61579.287
555.4723.35742.98254.66294.93835.56920.2938-0.1017-0.7951.02-0.1624-0.54151.77350.181-0.06840.94010.0680.07360.45290.09230.533489.2984185.501983.2717
562.4808-0.9985-1.20353.49652.74456.3773-0.1288-0.0135-0.633-0.0774-0.2184-0.15931.15770.26080.48770.81080.01710.02010.59110.05460.499486.093183.108678.0047
575.8759-1.3035-2.26836.66355.85248.60080.02450.70310.0911-0.4818-0.3062-0.0379-0.0026-0.40230.20660.76480.11910.01170.79960.04630.6581100.4016195.703569.9066
585.21322.08062.06754.3291-2.34045.5250.006-0.4346-0.41260.34390.0365-0.41371.39690.1378-0.02910.87770.18060.15790.64530.05750.618597.6071182.618685.6801
596.01784.56673.10864.40282.98432.5118-0.42580.6807-1.0469-0.6590.5131-1.30680.73320.8929-0.1210.94760.29930.11990.903-0.01790.785108.2543185.900279.4098
603.1471-3.8271-1.43396.03564.85017.87610.1028-1.1333-0.08491.8511-0.0384-0.51841.47150.84330.02230.94850.274-0.05840.84860.02750.5625108.0101192.814392.1385
619.36641.0968-0.32966.4279-4.22387.02740.22460.6763-0.4137-0.1971-0.02020.0578-0.32910.237-0.00370.7719-0.2165-0.12770.5843-0.03330.469672.8563210.709751.8303
628.85764.22897.17159.02082.77447.2078-1.23261.6008-0.9776-1.43751.354-1.50331.0984-0.3315-0.02160.4608-0.01860.0690.5002-0.14130.543282.9393206.174450.5051
632.7611-0.54251.27696.5272.46524.11950.46560.3465-0.4198-1.1472-0.1217-0.5981-0.54290.7714-0.33490.5424-0.07430.04720.5540.11730.346688.1947219.05553.4039
644.5622-3.3265-0.32696.99152.28859.2214-0.3725-0.23910.12690.1020.537-0.56980.77360.2247-0.15290.5944-0.0775-0.04650.4303-0.0140.47486.5763209.795361.835
656.62262.2061-3.87121.2749-0.07014.58640.3508-1.09850.58170.16970.12760.39640.11460.4492-0.59920.6623-0.0916-0.04230.63570.110.662586.7692216.029268.443
664.8863-4.1673-4.45758.17023.23854.38320.02390.485-1.4766-0.0288-0.61620.1108-0.69430.90220.70220.40210.0733-0.010.79910.03330.585289.6919217.928668.8886
677.5826-0.99341.21151.44831.85982.89740.29740.19891.681-0.50990.23640.1389-0.17480.2543-0.5880.6723-0.16220.08550.39510.05540.5786.513222.839662.2772
687.4321-4.5115-3.56444.12212.67428.074-0.1705-0.23660.5358-0.66370.4741-0.5144-0.45270.8438-0.30950.5187-0.18290.10450.48430.03640.629393.1126222.43562.1819
694.58912.09960.14934.7153-0.32487.8216-0.2062-0.058-0.542-0.13080.6318-0.40581.02210.2967-0.45290.69250.0274-0.00020.6848-0.0280.752886.8282203.435456.8149
706.2676-0.90711.76067.03190.84385.06560.36090.17550.7636-0.6544-0.1177-0.0575-0.6753-0.1139-0.24740.6196-0.12210.04580.4690.00440.438481.5292223.3254.6519
717.99262.58483.92844.2120.69228.591-0.26140.9546-0.5613-0.8330.1674-0.46830.17540.20140.07910.6201-0.07740.03660.5863-0.01910.485379.4554213.299646.9972
723.0353-3.12610.29473.465-1.25792.53420.431-0.10170.0809-0.2608-0.07830.27740.4185-1.2133-0.33280.6165-0.1333-0.09040.64780.14010.648267.1971216.386854.0747
731.3242-0.593-2.72688.50141.82817.54170.03610.2238-0.17140.3474-0.0177-0.3855-0.25590.858-0.02450.5907-0.1481-0.14541.0178-0.05730.61108.3104217.8841116.847
741.70051.6422.86755.8601-0.47167.05080.0074-0.19770.0632-0.47960.5819-0.86260.01161.2374-0.63970.6075-0.1668-0.02211.193-0.14120.816114.8108222.3304108.9813
756.51742.5296-3.48253.52651.3157.64760.0928-0.0484-0.40670.24320.1044-1.22850.06171.3049-0.07720.37890.1249-0.09460.85510.03730.7272115.1638209.4011103.1186
762.5176-0.64021.97316.91783.02867.6177-0.07940.51950.323-0.5620.3863-0.4739-0.23260.4128-0.38380.6031-0.0723-0.0180.71780.07670.616107.1746218.641699.8999
776.011-1.7949-5.12443.01431.93347.9715-0.01330.7541-0.1108-0.3005-0.39180.2671-0.4953-0.62470.33310.79210.0418-0.01780.8662-0.01140.6657101.6811212.377296.2649
787.20244.3888-3.59099.5792-1.9425.52391.4029-0.69550.2247-0.0746-0.7627-0.385-0.30581.4631-0.70.4676-0.05510.05950.87120.15320.5638102.8617210.452493.5727
797.02160.0352-6.39451.10690.71559.0098-0.3209-0.0054-0.60690.267-0.085-0.3540.65270.40660.35170.57090.1496-0.02920.72260.03480.7321106.7609205.59599.8334
806.8032.1808-5.00766.9418-2.0868.15930.1479-0.0254-0.2960.160.0432-0.88250.10310.8774-0.24440.35720.0948-0.02630.83880.0140.4137110.3684205.949294.2963
810.6647-0.28960.6438.7720.6293.5945-0.51220.6410.127-0.43810.5536-0.6794-0.4641.0672-0.11780.6898-0.2539-0.03661.0764-0.00210.7076111.5566225.0201102.3007
822.6384-0.6937-1.00984.01090.22194.7512-0.6692-0.5241-0.17120.49950.4815-0.81450.43990.80310.13730.61320.0495-0.12060.91380.00320.7716110.5467205.1862108.12
835.384-4.6577-3.27126.85633.66978.12060.2217-0.74160.23330.44020.274-1.1727-0.09231.9299-0.52410.4591-0.0124-0.13061.202-0.07240.7381115.9194215.2636113.8717
846.7479-4.39291.72826.3614-4.3023.32710.069-0.9322-1.16821.2173-0.2181-0.99740.26830.5203-0.03560.5123-0.0587-0.05640.89710.06070.6904103.3773212.2423120.4884
853.7217-1.59532.52196.15672.17254.75-0.13550.19170.1687-0.59270.6140.3964-0.71150.6446-0.36830.7677-0.36330.18450.85420.05920.595101.2836235.150769.0108
863.3548-1.1318-2.06742.4868-3.20198.2088-0.1213-0.34720.6016-0.57680.8556-0.8382-0.78590.8787-0.83270.502-0.29440.08820.9526-0.13420.7629109.0166236.625476.8768
877.41563.72462.58617.15064.89068.2165-0.16180.93411.57420.12110.2029-0.0289-0.92771.58380.10680.6683-0.23740.05460.4960.14980.7025100.1007246.009482.7199
886.63031.2995-2.83998.43160.71318.60080.0594-0.71470.09430.25890.2893-0.47350.03350.7476-0.36230.4366-0.0405-0.00210.66840.06770.509100.9995233.83885.9545
894.43386.3747-1.49699.9323-0.60425.0233-0.2223-0.24150.11170.2580.22730.4820.42580.19820.24680.6547-0.00150.01660.7257-0.08910.596992.6848234.371589.5886
903.68290.48-1.32196.63180.01070.5503-0.35971.4341-0.87230.6660.9152-0.4446-0.60761.4089-0.55960.4043-0.1515-0.12150.87010.03820.494892.153236.569292.2694
916.95944.86195.41385.52436.46492.6263-0.0095-0.22151.03460.3057-0.58360.72430.3277-0.27210.64660.8153-0.1843-0.00390.55770.05350.753191.4651242.750186.0025
928.60683.45282.84365.80940.27396.40760.0012-0.57910.5925-0.19940.116-0.3964-1.05230.496-0.06960.4869-0.16330.02950.4732-0.07860.489894.261245.063491.5375
934.18-3.58461.9315.12711.54795.9782-0.0099-1.17240.2409-0.35210.0986-0.514-0.26251.0231-0.12620.6192-0.24160.07171.1975-0.00340.6399108.6177232.429483.567
941.2415-1.69740.22433.45261.94624.1875-0.25580.08760.4653-0.90890.1883-0.2487-0.49510.1356-0.01040.6413-0.24190.08090.7320.09860.783893.8577245.705577.7123
950.30170.3114-1.29066.89292.04978.5939-0.25910.31980.4022-0.49490.8207-0.8479-1.06161.5167-0.57260.7014-0.41450.0990.9511-0.05650.8483104.7926242.391571.9771
968.57864.6324.14483.56391.19033.23640.00770.41180.8402-1.5876-0.01370.4028-0.6517-0.19550.16510.722-0.2797-0.09650.87210.06840.649993.8096235.634665.3619
975.5330.45812.37257.0919-2.31598.06530.1717-0.79990.24250.3447-0.03310.04650.6822-0.163-0.010.6489-0.13870.1470.83540.02150.514770.8226215.2331133.9974
988.4826-1.73-6.14365.6252-2.02128.14830.1527-2.0031.25070.3047-0.1164-0.4779-0.9967-0.25660.03090.5894-0.13790.03040.6044-0.10030.536374.8311225.5331135.3111
996.18072.65610.24315.44672.48576.7801-0.4209-0.37570.2460.7830.7168-0.122-0.09860.857-0.5050.6148-0.0063-0.09860.74760.04650.516987.6173220.0263132.4679
1005.63121.507-0.69029.36740.58529.4544-0.0686-0.16860.249-0.40570.1118-0.3318-0.3306-0.0082-0.09660.50320.02140.04450.54860.00870.483279.9968225.4781124
1016.53564.50262.18626.09261.46944.47290.33420.71860.1011-0.39510.05090.01010.0954-0.2702-0.47320.509-0.09710.01610.76870.09660.713884.5305221.1602117.4105
1024.34032.73272.83914.31486.06888.84350.20830.06770.98470.8224-1.21521.02520.33090.75331.05260.8753-0.1707-0.05750.6640.05890.650987.9434221.8605116.9782
1033.89273.2927-0.57544.98581.71114.68260.1449-0.3924-1.01430.6470.3301-0.93830.22870.4204-0.50160.55590.0707-0.09680.6513-0.03280.582189.1033216.1357123.6025
1042.61571.20960.96937.91181.56826.176-0.117-0.49510.12670.72270.3184-0.305-0.04310.8515-0.1580.5064-0.0772-0.06710.6839-0.04010.55593.5271221.0547123.7034
1058.356-5.12291.63553.9903-2.39978.84390.16470.00370.2224-0.39480.4603-0.1404-0.89030.0462-0.58930.6591-0.13320.09190.6958-0.04390.63375.7025230.203128.9935
1066.1268-1.2955-1.15676.881-0.36763.1123-0.1806-0.4727-0.33790.85010.2804-0.59330.57880.1681-0.07660.7298-0.0093-0.04020.7328-0.01240.46985.8611212.3128131.2227
1075.60573.1896-0.35113.0699-2.70027.59040.3329-1.32610.2160.7242-0.3071-0.01840.2879-0.2569-0.04630.7559-0.130.01810.7495-0.04940.482577.3241218.0165138.8369
1084.26954.5214.60359.61440.58848.96530.1062-0.0005-0.66450.28620.26850.23290.9621-0.7912-0.47740.8839-0.24250.01580.90150.05870.638670.7736207.2141131.7597
1095.6781-1.7864-1.89328.012-3.55686.9190.1313-0.0730.65980.1311-0.10660.114-1.05470.0077-0.11560.823-0.1222-0.13930.4883-0.07160.672384.1298252.9638102.015
1107.18720.26443.73715.0428-4.78527.8105-0.2104-0.67071.17711.25430.0807-0.3210.20960.03740.19960.6764-0.134-0.06570.4263-0.02650.54481.2877252.2028112.7427
1118.7918-1.8631-4.14275.73351.86734.5373-0.0956-0.46920.67090.163-0.3540.855-1.7836-0.13940.48560.79490.1216-0.15260.6291-0.05420.740267.8002251.9627108.3086
1126.67481.797-2.0936.7452.51299.0831-0.0297-0.5347-0.13280.5348-0.30650.01640.3422-0.60640.23120.5962-0.0386-0.10730.56220.03320.456674.826241.7573110.7758
1139.8353-4.1907-4.46085.45354.08636.71760.54750.1662-0.79810.0599-0.5162-0.32510.3497-0.8266-0.1370.5367-0.0194-0.05850.68320.04350.528669.1534236.8227105.6748
1147.3051-1.5941-0.84838.689464.1060.2364-0.7224-0.24780.57080.42110.9885-0.32031.5946-0.74390.8304-0.08980.04010.66570.09050.536765.7961236.5647106.6676
1155.82971.2305-5.2473.52932.23569.2067-0.01640.18780.24-0.0553-0.44430.4702-0.8315-0.91410.44920.57750.1272-0.11010.76810.00310.644964.9055244.4402102.7456
1165.54662.3339-1.35647.59233.50548.7454-0.196-0.51880.59720.3927-0.27060.6512-0.0743-1.16280.48920.60740.1508-0.03590.7467-0.04220.690461.0098243.7975108.06
1176.617-2.55021.10578.93652.40153.24150.1696-0.4663-0.04720.5793-0.47270.36570.5232-0.56820.35490.7834-0.05930.0110.6961-0.00850.618380.1079245.0722115.9545
1188.7834-3.99560.41937.0269-1.16694.57320.05850.22950.6326-0.35-0.0628-0.1242-0.8774-0.59960.01730.8207-0.0097-0.10810.671-0.07890.713768.6639252.3975100.3636
1198.72711.694-2.75075.5249-1.54872.54880.0018-1.19671.46320.0638-0.0307-0.0816-1.15910.43150.10490.8984-0.0244-0.09440.6368-0.1560.622678.547257.6172106.5634
1207.0932-1.2462-5.29613.03422.33525.0150.66441.0161-1.1713-1.5969-0.0432-0.6247-1.0532-1.1131-0.25051.0287-0.0152-0.09330.66190.08210.709883.16252.678993.7495
Refinement TLS group
IDRefine-IDRefine TLS-IDSelection details
1X-RAY DIFFRACTION1(CHAIN A AND RESID 1:15)
2X-RAY DIFFRACTION2(CHAIN A AND RESID 16:26)
3X-RAY DIFFRACTION3(CHAIN A AND RESID 27:40)
4X-RAY DIFFRACTION4(CHAIN A AND RESID 41:66)
5X-RAY DIFFRACTION5(CHAIN A AND RESID 67:75)
6X-RAY DIFFRACTION6(CHAIN A AND RESID 76:86)
7X-RAY DIFFRACTION7(CHAIN A AND RESID 87:106)
8X-RAY DIFFRACTION8(CHAIN A AND RESID 107:126)
9X-RAY DIFFRACTION9(CHAIN A AND RESID 127:147)
10X-RAY DIFFRACTION10(CHAIN A AND RESID 148:177)
11X-RAY DIFFRACTION11(CHAIN A AND RESID 178:196)
12X-RAY DIFFRACTION12(CHAIN A AND RESID 197:204)
13X-RAY DIFFRACTION13(CHAIN B AND RESID 1:15)
14X-RAY DIFFRACTION14(CHAIN B AND RESID 16:26)
15X-RAY DIFFRACTION15(CHAIN B AND RESID 27:40)
16X-RAY DIFFRACTION16(CHAIN B AND RESID 41:66)
17X-RAY DIFFRACTION17(CHAIN B AND RESID 67:75)
18X-RAY DIFFRACTION18(CHAIN B AND RESID 76:86)
19X-RAY DIFFRACTION19(CHAIN B AND RESID 87:106)
20X-RAY DIFFRACTION20(CHAIN B AND RESID 107:126)
21X-RAY DIFFRACTION21(CHAIN B AND RESID 127:147)
22X-RAY DIFFRACTION22(CHAIN B AND RESID 148:177)
23X-RAY DIFFRACTION23(CHAIN B AND RESID 178:196)
24X-RAY DIFFRACTION24(CHAIN B AND RESID 197:204)
25X-RAY DIFFRACTION25(CHAIN C AND RESID 1:15)
26X-RAY DIFFRACTION26(CHAIN C AND RESID 16:26)
27X-RAY DIFFRACTION27(CHAIN C AND RESID 27:40)
28X-RAY DIFFRACTION28(CHAIN C AND RESID 41:66)
29X-RAY DIFFRACTION29(CHAIN C AND RESID 67:75)
30X-RAY DIFFRACTION30(CHAIN C AND RESID 76:86)
31X-RAY DIFFRACTION31(CHAIN C AND RESID 87:106)
32X-RAY DIFFRACTION32(CHAIN C AND RESID 107:126)
33X-RAY DIFFRACTION33(CHAIN C AND RESID 127:147)
34X-RAY DIFFRACTION34(CHAIN C AND RESID 148:177)
35X-RAY DIFFRACTION35(CHAIN C AND RESID 178:196)
36X-RAY DIFFRACTION36(CHAIN C AND RESID 197:204)
37X-RAY DIFFRACTION37(CHAIN D AND RESID 1:15)
38X-RAY DIFFRACTION38(CHAIN D AND RESID 16:26)
39X-RAY DIFFRACTION39(CHAIN D AND RESID 27:40)
40X-RAY DIFFRACTION40(CHAIN D AND RESID 41:66)
41X-RAY DIFFRACTION41(CHAIN D AND RESID 67:75)
42X-RAY DIFFRACTION42(CHAIN D AND RESID 76:86)
43X-RAY DIFFRACTION43(CHAIN D AND RESID 87:106)
44X-RAY DIFFRACTION44(CHAIN D AND RESID 107:126)
45X-RAY DIFFRACTION45(CHAIN D AND RESID 127:147)
46X-RAY DIFFRACTION46(CHAIN D AND RESID 148:177)
47X-RAY DIFFRACTION47(CHAIN D AND RESID 178:196)
48X-RAY DIFFRACTION48(CHAIN D AND RESID 197:204)
49X-RAY DIFFRACTION49(CHAIN E AND RESID 1:15)
50X-RAY DIFFRACTION50(CHAIN E AND RESID 16:26)
51X-RAY DIFFRACTION51(CHAIN E AND RESID 27:40)
52X-RAY DIFFRACTION52(CHAIN E AND RESID 41:66)
53X-RAY DIFFRACTION53(CHAIN E AND RESID 67:75)
54X-RAY DIFFRACTION54(CHAIN E AND RESID 76:86)
55X-RAY DIFFRACTION55(CHAIN E AND RESID 87:106)
56X-RAY DIFFRACTION56(CHAIN E AND RESID 107:126)
57X-RAY DIFFRACTION57(CHAIN E AND RESID 127:147)
58X-RAY DIFFRACTION58(CHAIN E AND RESID 148:177)
59X-RAY DIFFRACTION59(CHAIN E AND RESID 178:196)
60X-RAY DIFFRACTION60(CHAIN E AND RESID 197:204)
61X-RAY DIFFRACTION61(CHAIN F AND RESID 1:15)
62X-RAY DIFFRACTION62(CHAIN F AND RESID 16:26)
63X-RAY DIFFRACTION63(CHAIN F AND RESID 27:40)
64X-RAY DIFFRACTION64(CHAIN F AND RESID 41:66)
65X-RAY DIFFRACTION65(CHAIN F AND RESID 67:75)
66X-RAY DIFFRACTION66(CHAIN F AND RESID 76:86)
67X-RAY DIFFRACTION67(CHAIN F AND RESID 87:106)
68X-RAY DIFFRACTION68(CHAIN F AND RESID 107:126)
69X-RAY DIFFRACTION69(CHAIN F AND RESID 127:147)
70X-RAY DIFFRACTION70(CHAIN F AND RESID 148:177)
71X-RAY DIFFRACTION71(CHAIN F AND RESID 178:196)
72X-RAY DIFFRACTION72(CHAIN F AND RESID 197:204)
73X-RAY DIFFRACTION73(CHAIN G AND RESID 1:15)
74X-RAY DIFFRACTION74(CHAIN G AND RESID 16:26)
75X-RAY DIFFRACTION75(CHAIN G AND RESID 27:40)
76X-RAY DIFFRACTION76(CHAIN G AND RESID 41:66)
77X-RAY DIFFRACTION77(CHAIN G AND RESID 67:75)
78X-RAY DIFFRACTION78(CHAIN G AND RESID 76:86)
79X-RAY DIFFRACTION79(CHAIN G AND RESID 87:106)
80X-RAY DIFFRACTION80(CHAIN G AND RESID 107:126)
81X-RAY DIFFRACTION81(CHAIN G AND RESID 127:147)
82X-RAY DIFFRACTION82(CHAIN G AND RESID 148:177)
83X-RAY DIFFRACTION83(CHAIN G AND RESID 178:196)
84X-RAY DIFFRACTION84(CHAIN G AND RESID 197:204)
85X-RAY DIFFRACTION85(CHAIN H AND RESID 1:15)
86X-RAY DIFFRACTION86(CHAIN H AND RESID 16:26)
87X-RAY DIFFRACTION87(CHAIN H AND RESID 27:40)
88X-RAY DIFFRACTION88(CHAIN H AND RESID 41:66)
89X-RAY DIFFRACTION89(CHAIN H AND RESID 67:75)
90X-RAY DIFFRACTION90(CHAIN H AND RESID 76:86)
91X-RAY DIFFRACTION91(CHAIN H AND RESID 87:106)
92X-RAY DIFFRACTION92(CHAIN H AND RESID 107:126)
93X-RAY DIFFRACTION93(CHAIN H AND RESID 127:147)
94X-RAY DIFFRACTION94(CHAIN H AND RESID 148:177)
95X-RAY DIFFRACTION95(CHAIN H AND RESID 178:196)
96X-RAY DIFFRACTION96(CHAIN H AND RESID 197:204)
97X-RAY DIFFRACTION97(CHAIN I AND RESID 1:15)
98X-RAY DIFFRACTION98(CHAIN I AND RESID 16:26)
99X-RAY DIFFRACTION99(CHAIN I AND RESID 27:40)
100X-RAY DIFFRACTION100(CHAIN I AND RESID 41:66)
101X-RAY DIFFRACTION101(CHAIN I AND RESID 67:75)
102X-RAY DIFFRACTION102(CHAIN I AND RESID 76:86)
103X-RAY DIFFRACTION103(CHAIN I AND RESID 87:106)
104X-RAY DIFFRACTION104(CHAIN I AND RESID 107:126)
105X-RAY DIFFRACTION105(CHAIN I AND RESID 127:147)
106X-RAY DIFFRACTION106(CHAIN I AND RESID 148:177)
107X-RAY DIFFRACTION107(CHAIN I AND RESID 178:196)
108X-RAY DIFFRACTION108(CHAIN I AND RESID 197:204)
109X-RAY DIFFRACTION109(CHAIN J AND RESID 1:15)
110X-RAY DIFFRACTION110(CHAIN J AND RESID 16:26)
111X-RAY DIFFRACTION111(CHAIN J AND RESID 27:40)
112X-RAY DIFFRACTION112(CHAIN J AND RESID 41:66)
113X-RAY DIFFRACTION113(CHAIN J AND RESID 67:75)
114X-RAY DIFFRACTION114(CHAIN J AND RESID 76:86)
115X-RAY DIFFRACTION115(CHAIN J AND RESID 87:106)
116X-RAY DIFFRACTION116(CHAIN J AND RESID 107:126)
117X-RAY DIFFRACTION117(CHAIN J AND RESID 127:147)
118X-RAY DIFFRACTION118(CHAIN J AND RESID 148:177)
119X-RAY DIFFRACTION119(CHAIN J AND RESID 178:196)
120X-RAY DIFFRACTION120(CHAIN J AND RESID 197:204)

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