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- PDB-5jj3: Refined Structure of the Mature Virion Conformation of P22 Portal... -

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Basic information

Entry
Database: PDB / ID: 5jj3
TitleRefined Structure of the Mature Virion Conformation of P22 Portal Protein
ComponentsPortal protein
KeywordsVIRAL PROTEIN / portal protein / dodecamer / packaging motor / procapsid
Function / homologyPhage P22-like portal protein / Phage P22-like portal protein / viral DNA genome packaging, headful / viral portal complex / symbiont genome ejection through host cell envelope, short tail mechanism / viral DNA genome packaging / virion assembly / Portal protein
Function and homology information
Biological speciesEnterobacteria phage P22 (virus)
MethodX-RAY DIFFRACTION / SYNCHROTRON / MOLECULAR REPLACEMENT / Resolution: 7 Å
AuthorsLokareddy, R.K. / Sankhala, R.S. / Cingolani, G.
Funding support United States, 2items
OrganizationGrant numberCountry
National Institutes of Health/National Institute of General Medical Sciences (NIH/NIGMS)GM100888 United States
National Institutes of Health/National Cancer Institute (NIH/NCI)P30CA56036 United States
CitationJournal: Nat Commun / Year: 2017
Title: Portal protein functions akin to a DNA-sensor that couples genome-packaging to icosahedral capsid maturation.
Authors: Lokareddy, R.K. / Sankhala, R.S. / Roy, A. / Afonine, P.V. / Motwani, T. / Teschke, C.M. / Parent, K.N. / Cingolani, G.
History
DepositionApr 22, 2016Deposition site: RCSB / Processing site: RCSB
Revision 1.0Feb 8, 2017Provider: repository / Type: Initial release
Revision 1.1Feb 15, 2017Group: Database references
Revision 1.2Sep 27, 2017Group: Author supporting evidence / Category: pdbx_audit_support / Item: _pdbx_audit_support.funding_organization
Revision 1.3Dec 4, 2019Group: Author supporting evidence / Category: pdbx_audit_support / Item: _pdbx_audit_support.funding_organization
Revision 1.4Sep 27, 2023Group: Data collection / Database references / Refinement description
Category: chem_comp_atom / chem_comp_bond ...chem_comp_atom / chem_comp_bond / database_2 / pdbx_initial_refinement_model
Item: _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: Portal protein
B: Portal protein
C: Portal protein
D: Portal protein
E: Portal protein
F: Portal protein
G: Portal protein
H: Portal protein
I: Portal protein
J: Portal protein
K: Portal protein
L: Portal protein


Theoretical massNumber of molelcules
Total (without water)993,95312
Polymers993,95312
Non-polymers00
Water0
1


  • Idetical with deposited unit
  • defined by author&software
TypeNameSymmetry operationNumber
identity operation1_555x,y,z1
Buried area149200 Å2
ΔGint-558 kcal/mol
Surface area378100 Å2
MethodPISA
Unit cell
Length a, b, c (Å)409.043, 409.043, 260.000
Angle α, β, γ (deg.)90.00, 90.00, 90.00
Int Tables number79
Space group name H-MI4

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Components

#1: Protein
Portal protein / Gene product 1 / Gp1 / Head-to-tail connector


Mass: 82829.375 Da / Num. of mol.: 12
Source method: isolated from a genetically manipulated source
Source: (gene. exp.) Enterobacteria phage P22 (virus) / Production host: Escherichia coli (E. coli) / References: UniProt: P26744

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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: 5.47 Å3/Da / Density % sol: 77.52 %
Crystal growTemperature: 293 K / Method: vapor diffusion, hanging drop / pH: 5.6
Details: 30% tert-butanol, 70 mM sodium chloride, 2.5% PEG400 in 0.1 M sodium acetate

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Data collection

DiffractionMean temperature: 100 K
Diffraction sourceSource: SYNCHROTRON / Site: SSRL / Beamline: BL14-1 / Wavelength: 0.9 Å
DetectorType: RAYONIX MX325HE / Detector: CCD / Date: Feb 14, 2015
RadiationProtocol: SINGLE WAVELENGTH / Monochromatic (M) / Laue (L): M / Scattering type: x-ray
Radiation wavelengthWavelength: 0.9 Å / Relative weight: 1
ReflectionResolution: 7→15 Å / Num. obs: 33729 / % possible obs: 98.8 % / Redundancy: 3.9 % / Net I/σ(I): 19.4

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Processing

Software
NameVersionClassification
PHENIX(1.10.1_2155: ???)refinement
HKL-2000data reduction
HKL-2000data scaling
PHENIX(1.10.1_2155: ???)phasing
RefinementMethod to determine structure: MOLECULAR REPLACEMENT
Starting model: 3LJ5

3lj5


Resolution: 7→14.993 Å / SU ML: 0.98 / Cross valid method: FREE R-VALUE / σ(F): 0.66 / Phase error: 28.1
RfactorNum. reflection% reflection
Rfree0.2597 1561 5.19 %
Rwork0.239 --
obs0.2401 30078 99.05 %
Solvent computationShrinkage radii: 0.9 Å / VDW probe radii: 1.11 Å
Refinement stepCycle: LAST / Resolution: 7→14.993 Å
ProteinNucleic acidLigandSolventTotal
Num. atoms64536 0 0 0 64536
Refine LS restraints
Refine-IDTypeDev idealNumber
X-RAY DIFFRACTIONf_bond_d0.00465784
X-RAY DIFFRACTIONf_angle_d1.01489148
X-RAY DIFFRACTIONf_dihedral_angle_d12.28540056
X-RAY DIFFRACTIONf_chiral_restr0.0579636
X-RAY DIFFRACTIONf_plane_restr0.00711928
LS refinement shell
Resolution (Å)Rfactor RfreeNum. reflection RfreeRfactor RworkNum. reflection RworkRefine-ID% reflection obs (%)
7.0001-7.20170.39851310.40782588X-RAY DIFFRACTION98
7.2017-7.42880.41791300.3832563X-RAY DIFFRACTION99
7.4288-7.68750.36371310.35812605X-RAY DIFFRACTION99
7.6875-7.98640.34861310.30922581X-RAY DIFFRACTION99
7.9864-8.33810.29411290.28592622X-RAY DIFFRACTION99
8.3381-8.76120.25781320.23292587X-RAY DIFFRACTION99
8.7612-9.28580.231290.20712611X-RAY DIFFRACTION99
9.2858-9.9640.21881310.1912633X-RAY DIFFRACTION99
9.964-10.89710.21521430.1872576X-RAY DIFFRACTION99
10.8971-12.32010.19942450.15942496X-RAY DIFFRACTION99
12.3201-14.99320.24091290.19032655X-RAY DIFFRACTION99
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)
10.6712-0.12960.11580.3853-0.54672.2647-0.427-0.012-0.0767-1.25590.11310.69120.44420.0942-1.49140.7593-0.2579-0.44140.9952-0.20560.4338-119.1664-40.9141-120.1722
21.5867-0.54860.53990.9404-0.13132.627-0.3280.97030.0894-0.15680.30820.4051-0.407-0.70690.65361.1172-0.6872-0.34321.2014-0.43261.1022-114.325-29.3673-132.4508
32.383-0.4256-0.24614.013-1.26873.06790.3162-0.6424-1.32570.3796-0.6525-0.0831.0872-0.44010.0681.1854-0.27510.26721.2879-0.11961.428-132.6932-84.912-102.974
40.65350.29570.10860.2007-0.22390.7514-0.02320.6789-0.28220.2310.0481-0.4731-0.5564-0.00610.60761.243-0.8998-0.44261.5019-0.51960.5965-113.7152-20.7104-117.319
53.62240.84220.22431.7313-0.38080.9841-0.06660.37040.6392-0.42930.39610.17050.0356-0.5158-0.22390.5184-0.26780.02921.24450.2551.2822-126.5624-8.1735-93.4
61.79091.6030.3781.44910.41841.85740.6072-0.2626-0.1167-0.1244-0.2659-0.9786-0.58520.5583-0.09740.7912-0.0893-0.48572.1360.44791.0066-106.134482.2199-26.2849
70.6486-0.3099-0.71651.1869-0.94322.5050.23150.9387-1.3572-0.79131.1939-0.52640.86340.20483.25250.7451-0.7276-0.43610.4469-1.38121.2594-94.9557-57.0611-113.9344
80.48250.38010.31150.84280.87111.55170.14730.36270.3948-0.4670.10890.4894-1.27380.24650.52881.0398-0.2214-0.4760.61110.02920.2684-95.1421-29.1679-104.577
90.6963-0.14880.00890.6962-0.13830.6550.1198-0.39260.0035-0.2614-0.17960.15940.2216-0.0416-0.40510.474-0.58550.13111.0559-0.59280.6972-88.6345-37.4006-116.3219
101.53190.1365-0.9112.1444-1.39571.1451-0.16810.44780.5791-0.42761.06740.00690.1374-0.17440.20161.3188-0.26330.08811.0781-0.41780.6896-81.0293-32.7596-120.2409
112.2889-1.7628-0.40321.471102.47790.33440.7194-1.14290.78880.78730.67580.7387-0.41741.92680.7777-0.02570.63610.8931-0.58661.295-120.8609-84.4823-110.5161
122.698-1.1547-0.10571.70190.79642.80440.11120.2123-1.1294-0.128-0.88130.22410.87160.5393-0.9120.95130.75910.04991.90980.32441.5987-118.0394-83.0927-100.9355
130.43120.5156-0.17530.7071-0.2310.06180.62980.280.2331-0.0520.0715-0.3329-0.42070.83641.06120.826-0.5113-0.32531.3071-1.63710.8867-86.3638-23.8204-106.3023
142.90521.58380.74181.52740.01441.1606-0.10850.13011.0085-0.00360.28410.4717-0.5549-0.37720.99080.5983-0.5951-0.59130.512-0.33192.287-107.0404-8.672-90.8576
151.2761-0.0038-0.26481.62811.24151.10120.2657-0.10130.13420.3315-0.19630.214-0.20610.68290.02991.66970.01450.27760.9525-0.34020.7074-107.674679.6369-18.0717
161.56640.49390.14441.6233-0.56010.9323-0.1674-0.274-0.8190.38710.8899-0.77750.0802-0.05290.20370.4364-0.0174-0.3061.1242-0.3210.5479-74.2176-48.9957-92.983
171.74010.0530.57060.7167-1.25942.25720.70580.6964-0.4545-0.12010.0255-0.05150.65460.9710.33410.7816-0.2410.39471.3838-0.55270.7288-58.6647-40.9673-93.8613
184.3427-0.1032-0.53921.098-0.24860.723-0.57030.9964-0.9019-0.47410.52620.87960.9243-0.8147-0.1801-0.16440.691-0.11650.9367-0.51661.9693-105.6189-85.5624-106.5532
191.56580.3861-0.65421.0547-0.69941.2751-0.007-0.4584-0.27010.12220.05770.21310.33390.00090.75320.37530.4813-0.11480.7656-0.94290.6497-88.7588-58.4868-90.4608
202.70920.09130.86351.3694-0.051.188-0.15150.12280.8156-0.43630.1342-0.1615-0.1159-0.2258-0.00090.5978-0.1664-0.8670.62910.13330.9909-91.5448-12.1539-79.346
211.3847-0.6008-0.92860.27540.30530.21270.56030.374-0.5-0.5990.35550.71550.4980.13233.58311.0167-0.79490.74841.87891.86870.8284-113.345177.637-11.8528
220.65440.35210.13850.9623-0.28331.4894-0.31110.2527-0.0029-0.28930.3788-0.67860.53460.3918-0.25650.50450.24280.37031.644-0.5049-0.0961-68.1591-57.2151-67.3679
231.49940.9173-0.59661.6564-1.82381.94260.05960.3193-0.2696-0.6191-0.5704-0.57440.50230.16660.32911.06330.3955-0.08281.369-0.51381.3779-53.0521-51.6937-60.419
242.4369-0.4065-0.85980.9679-0.66563.0277-0.398-0.0101-1.2192-0.4411-1.0821-0.00431.02990.0522-4.00921.2310.1872-0.44450.3382-0.00061.0922-97.5194-88.082-91.858
252.2153-0.05071.02790.53080.28152.9965-1.1110.43530.89880.4252-0.0622-0.2657-0.59661.3179-4.65451.3705-0.66130.080.885-0.54370.2201-77.3899-25.4659-59.8825
260.0194-0.0629-0.03540.1344-0.29090.4051-0.05910.062-0.1617-0.25510.0847-0.2544-0.27010.2911-0.14631.1857-0.17210.59392.01920.49661.1422-121.661276.676-9.3846
271.5976-0.8342-0.71461.22620.70071.1642-0.6358-1.2767-0.20830.86540.58840.70670.28030.74120.19071.6560.9796-0.01451.1203-0.0071.5622-73.8258-79.7344-37.4092
286.00792.0581-0.40931.6628-0.95122.4632-0.40031.3515-1.8071-0.54180.047-0.64811.01191.20421.94660.13880.06420.5732.04790.60050.2378-83.8104-76.9818-59.4
291.50910.52630.86090.60240.44561.8567-0.5188-0.22860.36280.07760.465-0.0131-0.34750.7897-0.39061.05440.2911-0.09681.3226-0.3580.4168-74.995-57.1328-38.3847
301.7241-0.4445-0.18332.97422.14333.3915-0.3543-0.0479-0.26580.8337-0.35330.49890.79670.8181-0.12861.04540.5155-0.24052.0664-0.27581.0478-62.987-59.3009-27.646
311.2279-0.26750.25150.9173-0.44660.2683-0.08350.17940.027-0.24270.2521-0.15750.5898-0.15870.81041.80210.784-0.11410.5694-0.01180.6366-84.0574-84.0882-61.5339
322.5958-0.4034-0.62191.3537-1.46722.06360.3742-0.3036-1.043-0.4149-0.96620.53721.4801-0.67490.25011.24880.07280.04341.64290.5491.0358-99.2816-90.6062-77.2691
332.13621.14431.65771.2383-0.27363.2348-0.5887-0.55120.47350.5437-0.9789-0.0743-0.59730.2471-3.57991.74380.09340.62391.5693-0.39280.2507-76.6147-48.2819-29.9711
343.9899-0.78330.29462.49940.58753.7951-0.58580.35111.036-0.2780.4745-0.5804-0.35330.05680.28590.9635-0.194-0.06431.0732-0.27530.7189-86.8453-23.7073-43.591
351.9182-1.8652-0.15916.47861.65851.799-0.14110.11210.02440.02430.1070.0976-0.1828-1.23840.20470.13920.01720.71741.7431-0.2161.0062-130.100977.0811-11.0603
360.8425-0.1127-0.23890.42870.76882.29330.4297-0.03260.10040.39050.7085-0.72141.60420.16084.14040.66920.50910.87881.73290.39310.0837-96.8939-71.2706-24.7068
371.02681.2814-0.0541.31710.19792.1768-0.7688-0.8585-0.25270.46890.39330.69460.26750.90460.08471.56770.56170.45631.49870.20350.9782-93.6751-69.1316-7.6095
380.56840.2181.27991.5665-0.34523.13141.07070.7465-0.0616-0.38661.03110.31570.73190.60735.28451.2808-0.51190.92380.8320.95481.1186-94.7171-98.4117-66.7355
391.5994-1.1526-0.14674.57282.73734.54020.67220.4043-0.79910.6431-1.25440.31591.33740.1043-0.21351.7067-0.002-0.17061.39920.28710.6003-103.7033-93.8741-67.2963
400.17760.2198-0.19660.69450.64212.2865-0.3679-0.3941-0.40980.7848-0.89750.3831-0.0589-0.1888-3.0861.03840.85541.0821.9607-0.18010.68-100.3243-53.9598-13.0724
410.6214-0.2971-0.4810.53130.12451.7589-0.1731-0.30770.06610.55730.12820.0592-0.05850.1609-0.88390.7756-0.03730.86811.2573-0.84480.4266-98.8952-28.5814-28.84
420.8784-0.5342-0.59235.86880.70291.5089-0.6316-0.4303-0.04980.33380.8961-0.1301-0.58140.0579-0.21640.9119-0.4072-0.59892.8884-0.12090.7718-136.617478.7438-16.5286
430.91250.1674-0.36230.5438-0.27561.4862-0.3804-0.4866-0.51050.82510.2403-0.30490.73620.7887-0.34650.86440.33170.41221.5270.6511.1548-123.2928-73.8723-22.3904
440.7050.5011-0.48010.3223-0.36841.1924-0.1414-0.2377-0.37240.61490.17150.1710.3441-0.90991.08641.75750.38991.39751.65720.11860.8599-127.8006-71.1403-4.3933
450.99350.2872-0.15613.4628-0.27825.89010.91860.58070.4175-0.56570.7954-0.08741.06791.48274.0581.3823-0.47561.03541.11830.65151.0132-106.1368-101.8344-56.1319
461.0029-1.0068-0.04620.69190.64372.87750.09990.2423-0.2331-0.0667-0.2408-0.06820.3475-1.34780.30441.0567-0.37750.69591.29870.54341.4483-121.038-76.3097-36.0506
471.6548-0.9042-1.08041.49771.29272.33370.5079-0.02430.63720.15310.2029-0.3346-1.08490.4999-0.08540.5280.21610.87371.4529-1.20581.025-117.1552-30.9057-21.8056
481.3298-0.4836-0.02573.2796-0.57161.0825-0.4059-0.21720.1090.57260.7707-0.4958-0.54460.1347-0.25831.3796-0.7449-0.18062.5376-0.29940.4319-139.535981.2765-24.228
490.7575-0.03510.28080.1396-0.52011.7775-0.47950.4616-0.39950.8935-0.12860.97380.6385-0.43990.04280.9568-0.36960.54281.4054-0.0541.461-147.7992-72.2084-30.2796
501.06980.04060.37330.39620.31150.37070.2218-0.1957-0.2050.8841-0.19720.31070.74290.19941.45740.51660.43881.42891.64230.17172.3758-153.4967-75.2571-17.4247
510.49120.55270.35220.87660.6583.7945-0.99040.5842-0.426-0.789-0.1875-0.4412-0.4491-0.8923-3.71161.85930.0921.59961.02390.02141.3034-166.8578-59.2633-14.877
520.4705-0.06820.22280.7226-1.10071.7258-0.01670.5703-0.7285-0.3064-0.26511.16810.1398-0.38120.13310.5285-0.39660.2351.6153-0.0851.7176-133.7456-84.6096-44.5983
530.7807-0.0066-0.11591.1436-0.35320.7552-0.6608-0.71350.61111.3828-0.02060.5464-0.2897-0.2258-2.66190.20660.88731.2291.1647-1.4161.1974-136.5067-30.3854-24.4294
542.35211.4854-0.21282.0164-0.56360.81190.43990.24430.1866-0.011-0.12240.3478-0.2502-0.4753-0.09151.65460.1510.15942.88310.1552-0.0609-137.699983.7563-32.5178
552.4494-0.2909-0.10040.2252-0.78452.85990.1110.5353-0.52880.37790.11651.16440.62470.40480.19390.6503-0.23390.25051.46610.08351.7104-168.7424-65.1479-46.2647
561.67081.00850.42981.4851-0.26771.7650.1381-0.4302-0.9547-0.0559-0.20630.7899-0.01220.85680.27521.1898-0.19250.64832.4248-0.18762.596-186.2121-57.3622-37.7358
571.5291-0.1909-0.30020.6714-0.26211.1976-0.29750.2509-0.5770.19040.01240.46021.035-0.347-0.06821.1743-0.86310.22551.1504-0.35862.5988-146.6326-90.4168-57.5516
581.1389-0.14190.57590.4025-0.36581.3580.0121-1.2457-0.34160.1780.50030.83280.1476-0.92962.13750.70791.13520.36011.21-0.28362.113-160.2253-33.8974-38.5545
591.6689-0.96270.0991.6016-0.32161.2372-0.163-0.18370.73680.90240.34170.4556-0.109-0.4328-0.29021.61820.07670.00961.6948-0.2970.6379-132.523184.2408-38.5668
601.8443-1.35071.04861.0239-0.58271.3297-0.04390.0918-0.83350.0241-0.11951.2820.1189-0.52620.27450.87060.1712-0.16010.9367-0.84832.7064-181.4864-66.7888-81.8553
614.6793-1.6224-0.49892.748-0.413.4775-0.1060.2859-1.8021-0.1126-0.0711.03271.0957-0.79591.06280.65550.13830.69791.3336-0.31991.6083-161.6911-73.8344-69.6603
621.809-0.1217-0.83950.3299-0.73232.22720.26480.51010.39720.04150.21190.5229-0.5271-0.86210.53250.6990.0556-0.28342.0988-0.38711.5634-177.0921-48.3775-69.4615
632.7509-0.8006-0.06190.5581-0.10211.1524-0.1098-0.8808-0.38290.07570.1737-0.20590.10760.0193-0.2340.66120.4268-0.29681.6481-0.28643.2507-192.7441-46.4267-72.3538
641.07130.3790.00390.7244-0.17620.0742-0.0840.35350.0397-0.09610.2320.6448-0.24290.20951.26871.3706-0.9368-1.04061.3759-0.8492.3248-181.9702-55.8796-80.2771
652.87311.2344-1.220.68010.15353.4129-0.2770.8239-1.6588-1.0339-0.18-0.37811.20471.20070.83011.28610.1054-0.091.17330.05742.0671-147.7934-99.0233-66.9201
660.93850.2294-0.68270.0929-0.3441.55280.4289-0.07530.5142-0.27620.0297-0.56520.3866-0.38960.50810.606-0.7085-0.06781.2594-0.13832.0855-159.3782-65.5556-71.7027
670.6286-0.1343-0.34640.3518-0.13010.6228-0.01-0.5353-0.04680.1149-0.07791.41140.1068-0.05690.30640.77981.12330.07111.4682-0.20631.5852-159.4954-21.5401-53.233
681.0973-0.08280.26661.9197-0.63070.1346-0.322-0.37410.18260.55060.64870.2345-0.251-0.4589-0.24611.86881.01891.28662.65410.02660.8784-123.813686.5568-41.5065
692.4186-0.8587-0.32750.2674-0.06682.1608-0.0075-0.559-0.2842-1.0647-0.52871.3320.0889-0.49920.26670.94430.0041-0.64691.2654-0.27521.7883-171.2798-44.3708-100.8707
702.5865-0.409-0.05831.5594-0.67850.72840.22790.3598-0.0046-0.2986-0.9054-1.55070.3709-0.0914-0.10471.1926-0.3208-0.37161.4966-0.3890.5174-153.5362-71.3317-86.9273
713.9248-0.2481-0.30252.4085-1.67264.0449-0.1383-0.61020.32450.9238-0.35180.8769-0.43540.2589-0.28640.75620.24070.25281.04970.0190.9596-156.8212-15.554-71.6835
721.15031.510.87695.33490.26850.90950.2267-0.9548-0.093-0.2664-1.25380.0015-0.3388-0.35170.20410.5880.17260.70882.145-0.25210.9268-115.406686.2545-39.8015
732.5108-1.1864-0.17970.5427-0.06163.8759-0.5252-0.3865-0.353-1.17320.02750.97230.7940.2723-0.75261.4727-0.2184-0.37480.9298-0.77741.0597-144.8449-57.5232-115.9174
740.68980.20580.10190.6726-0.0250.37480.120.24550.5439-0.32020.15280.9145-0.71820.43160.40551.201-0.5855-0.20190.82520.00351.2379-147.0077-33.8209-113.6228
751.2710.04520.32531.14040.76870.57370.103-0.0857-0.3101-0.36870.4169-0.18620.3469-0.6730.57041.7149-0.3054-1.28071.90260.01371.5058-152.019-28.1412-128.0011
762.23480.33471.13371.1769-0.38652.2480.5273-1.4346-1.4750.001-0.7838-0.22070.2255-0.2007-0.27141.2779-0.36580.3331.4436-1.09390.3545-142.8533-76.0482-102.083
771.3103-0.9421-0.05380.69230.08543.0002-0.14120.3133-0.1667-0.53280.0332-1.0795-0.5769-1.2570.05750.6581-0.5383-0.23981.40250.18491.3197-143.1699-22.1353-113.9368
781.9184-0.3568-0.97120.8331-0.72121.75910.1175-0.19640.99670.57760.25010.1071-0.57710.12220.03270.84160.18040.23950.30790.16042.3374-144.8001-10.6351-86.387
791.23261.0098-0.22092.6097-0.51280.70740.3489-0.4079-0.3865-0.8864-0.5626-0.7396-0.8134-0.50420.40080.30870.32860.13211.807-0.13851.3618-108.921884.6419-34.1545
Refinement TLS group
IDRefine-IDRefine TLS-IDSelection details
1X-RAY DIFFRACTION1chain 'A' and (resid 9 through 180 )
2X-RAY DIFFRACTION2chain 'A' and (resid 181 through 318 )
3X-RAY DIFFRACTION3chain 'A' and (resid 319 through 427 )
4X-RAY DIFFRACTION4chain 'A' and (resid 428 through 515 )
5X-RAY DIFFRACTION5chain 'A' and (resid 516 through 609 )
6X-RAY DIFFRACTION6chain 'A' and (resid 610 through 715 )
7X-RAY DIFFRACTION7chain 'B' and (resid 9 through 73 )
8X-RAY DIFFRACTION8chain 'B' and (resid 74 through 119 )
9X-RAY DIFFRACTION9chain 'B' and (resid 120 through 180 )
10X-RAY DIFFRACTION10chain 'B' and (resid 181 through 318 )
11X-RAY DIFFRACTION11chain 'B' and (resid 319 through 370 )
12X-RAY DIFFRACTION12chain 'B' and (resid 371 through 427 )
13X-RAY DIFFRACTION13chain 'B' and (resid 428 through 515 )
14X-RAY DIFFRACTION14chain 'B' and (resid 516 through 609 )
15X-RAY DIFFRACTION15chain 'B' and (resid 610 through 715 )
16X-RAY DIFFRACTION16chain 'C' and (resid 9 through 180 )
17X-RAY DIFFRACTION17chain 'C' and (resid 181 through 318 )
18X-RAY DIFFRACTION18chain 'C' and (resid 319 through 370 )
19X-RAY DIFFRACTION19chain 'C' and (resid 371 through 515 )
20X-RAY DIFFRACTION20chain 'C' and (resid 516 through 609 )
21X-RAY DIFFRACTION21chain 'C' and (resid 610 through 715 )
22X-RAY DIFFRACTION22chain 'D' and (resid 9 through 180 )
23X-RAY DIFFRACTION23chain 'D' and (resid 181 through 318 )
24X-RAY DIFFRACTION24chain 'D' and (resid 319 through 427 )
25X-RAY DIFFRACTION25chain 'D' and (resid 428 through 609 )
26X-RAY DIFFRACTION26chain 'D' and (resid 610 through 715 )
27X-RAY DIFFRACTION27chain 'E' and (resid 9 through 40 )
28X-RAY DIFFRACTION28chain 'E' and (resid 41 through 72 )
29X-RAY DIFFRACTION29chain 'E' and (resid 73 through 180 )
30X-RAY DIFFRACTION30chain 'E' and (resid 181 through 281 )
31X-RAY DIFFRACTION31chain 'E' and (resid 282 through 370 )
32X-RAY DIFFRACTION32chain 'E' and (resid 371 through 427 )
33X-RAY DIFFRACTION33chain 'E' and (resid 428 through 515 )
34X-RAY DIFFRACTION34chain 'E' and (resid 516 through 609 )
35X-RAY DIFFRACTION35chain 'E' and (resid 610 through 715 )
36X-RAY DIFFRACTION36chain 'F' and (resid 9 through 180 )
37X-RAY DIFFRACTION37chain 'F' and (resid 181 through 318 )
38X-RAY DIFFRACTION38chain 'F' and (resid 319 through 370 )
39X-RAY DIFFRACTION39chain 'F' and (resid 371 through 427 )
40X-RAY DIFFRACTION40chain 'F' and (resid 428 through 515 )
41X-RAY DIFFRACTION41chain 'F' and (resid 516 through 609 )
42X-RAY DIFFRACTION42chain 'F' and (resid 610 through 715 )
43X-RAY DIFFRACTION43chain 'G' and (resid 9 through 131 )
44X-RAY DIFFRACTION44chain 'G' and (resid 132 through 318 )
45X-RAY DIFFRACTION45chain 'G' and (resid 319 through 370 )
46X-RAY DIFFRACTION46chain 'G' and (resid 371 through 515 )
47X-RAY DIFFRACTION47chain 'G' and (resid 516 through 609 )
48X-RAY DIFFRACTION48chain 'G' and (resid 610 through 715 )
49X-RAY DIFFRACTION49chain 'H' and (resid 9 through 119 )
50X-RAY DIFFRACTION50chain 'H' and (resid 120 through 226 )
51X-RAY DIFFRACTION51chain 'H' and (resid 227 through 318 )
52X-RAY DIFFRACTION52chain 'H' and (resid 319 through 515 )
53X-RAY DIFFRACTION53chain 'H' and (resid 516 through 609 )
54X-RAY DIFFRACTION54chain 'H' and (resid 610 through 715 )
55X-RAY DIFFRACTION55chain 'I' and (resid 9 through 180 )
56X-RAY DIFFRACTION56chain 'I' and (resid 181 through 281 )
57X-RAY DIFFRACTION57chain 'I' and (resid 282 through 427 )
58X-RAY DIFFRACTION58chain 'I' and (resid 428 through 607 )
59X-RAY DIFFRACTION59chain 'I' and (resid 608 through 715 )
60X-RAY DIFFRACTION60chain 'J' and (resid 9 through 40 )
61X-RAY DIFFRACTION61chain 'J' and (resid 41 through 73 )
62X-RAY DIFFRACTION62chain 'J' and (resid 74 through 180 )
63X-RAY DIFFRACTION63chain 'J' and (resid 181 through 281 )
64X-RAY DIFFRACTION64chain 'J' and (resid 282 through 318 )
65X-RAY DIFFRACTION65chain 'J' and (resid 319 through 370 )
66X-RAY DIFFRACTION66chain 'J' and (resid 371 through 515 )
67X-RAY DIFFRACTION67chain 'J' and (resid 516 through 609 )
68X-RAY DIFFRACTION68chain 'J' and (resid 610 through 715 )
69X-RAY DIFFRACTION69chain 'K' and (resid 9 through 318 )
70X-RAY DIFFRACTION70chain 'K' and (resid 319 through 515 )
71X-RAY DIFFRACTION71chain 'K' and (resid 516 through 609 )
72X-RAY DIFFRACTION72chain 'K' and (resid 610 through 715 )
73X-RAY DIFFRACTION73chain 'L' and (resid 9 through 72 )
74X-RAY DIFFRACTION74chain 'L' and (resid 73 through 180 )
75X-RAY DIFFRACTION75chain 'L' and (resid 181 through 281 )
76X-RAY DIFFRACTION76chain 'L' and (resid 282 through 427 )
77X-RAY DIFFRACTION77chain 'L' and (resid 428 through 515 )
78X-RAY DIFFRACTION78chain 'L' and (resid 516 through 609 )
79X-RAY DIFFRACTION79chain 'L' and (resid 610 through 715 )

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