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- PDB-6s09: C-terminally extended and N-terminally truncated variant of FimA ... -

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Basic information

Entry
Database: PDB / ID: 6s09
TitleC-terminally extended and N-terminally truncated variant of FimA E. coli at 1.5 Angstrom resolution
ComponentsFimA
KeywordsSTRUCTURAL PROTEIN / FimA / pilus / monomer / subunit / pili / synthetic / construct / main structural subunit / high resolution / C terminus / reversed / Oligo Glycine / Linker
Function / homology
Function and homology information


cell adhesion involved in single-species biofilm formation / pilus / cell adhesion / identical protein binding
Similarity search - Function
Fimbrial-type adhesion domain / Fimbrial-type adhesion domain / Fimbrial protein / : / Fimbrial-type adhesion domain superfamily / Adhesion domain superfamily / Immunoglobulin-like / Sandwich / Mainly Beta
Similarity search - Domain/homology
ACETIC ACID / FimA / Type-1 fimbrial protein, A chain
Similarity search - Component
Biological speciesEscherichia coli (E. coli)
MethodX-RAY DIFFRACTION / SYNCHROTRON / MOLECULAR REPLACEMENT / molecular replacement / Resolution: 1.502 Å
AuthorsZyla, D. / Echeverria, B. / Glockshuber, R.
Funding support Switzerland, 2items
OrganizationGrant numberCountry
Swiss National Science Foundation310030B_176403/1 Switzerland
Swiss National Science Foundation31003A_156304 Switzerland
CitationJournal: J.Biol.Chem. / Year: 2020
Title: Donor strand sequence, rather than donor strand orientation, determines the stability and non-equilibrium folding of the type 1 pilus subunit FimA.
Authors: Zyla, D. / Echeverria, B. / Glockshuber, R.
History
DepositionJun 14, 2019Deposition site: PDBE / Processing site: PDBE
Revision 1.0Jul 15, 2020Provider: repository / Type: Initial release
Revision 1.1Aug 12, 2020Group: Database references / Category: citation / citation_author
Item: _citation.country / _citation.journal_abbrev ..._citation.country / _citation.journal_abbrev / _citation.journal_id_ASTM / _citation.journal_id_CSD / _citation.journal_id_ISSN / _citation.pdbx_database_id_DOI / _citation.pdbx_database_id_PubMed / _citation.title / _citation.year / _citation_author.name
Revision 1.2Sep 9, 2020Group: Database references / Category: citation / citation_author
Item: _citation.journal_volume / _citation.page_first ..._citation.journal_volume / _citation.page_first / _citation.page_last / _citation_author.identifier_ORCID / _citation_author.name
Revision 1.3Jan 24, 2024Group: 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
Revision 1.4Nov 20, 2024Group: Structure summary / Category: pdbx_entry_details / pdbx_modification_feature / Item: _pdbx_entry_details.has_protein_modification

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Structure visualization

Structure viewerMolecule:
MolmilJmol/JSmol

Downloads & links

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Assembly

Deposited unit
F: FimA
A: FimA
B: FimA
C: FimA
D: FimA
E: FimA
G: FimA
H: FimA
hetero molecules


Theoretical massNumber of molelcules
Total (without water)130,55215
Polymers129,9898
Non-polymers5637
Water35,3451962
1
F: FimA
hetero molecules


Theoretical massNumber of molelcules
Total (without water)16,3452
Polymers16,2491
Non-polymers961
Water181
TypeNameSymmetry operationNumber
identity operation1_555x,y,z1
2
A: FimA


Theoretical massNumber of molelcules
Total (without water)16,2491
Polymers16,2491
Non-polymers00
Water181
TypeNameSymmetry operationNumber
identity operation1_555x,y,z1
3
B: FimA
hetero molecules


Theoretical massNumber of molelcules
Total (without water)16,3452
Polymers16,2491
Non-polymers961
Water181
TypeNameSymmetry operationNumber
identity operation1_555x,y,z1
4
C: FimA
hetero molecules


Theoretical massNumber of molelcules
Total (without water)16,4284
Polymers16,2491
Non-polymers1793
Water181
TypeNameSymmetry operationNumber
identity operation1_555x,y,z1
5
D: FimA


Theoretical massNumber of molelcules
Total (without water)16,2491
Polymers16,2491
Non-polymers00
Water181
TypeNameSymmetry operationNumber
identity operation1_555x,y,z1
6
E: FimA
hetero molecules


Theoretical massNumber of molelcules
Total (without water)16,3452
Polymers16,2491
Non-polymers961
Water181
TypeNameSymmetry operationNumber
identity operation1_555x,y,z1
7
G: FimA


Theoretical massNumber of molelcules
Total (without water)16,2491
Polymers16,2491
Non-polymers00
Water181
TypeNameSymmetry operationNumber
identity operation1_555x,y,z1
8
H: FimA
hetero molecules


Theoretical massNumber of molelcules
Total (without water)16,3452
Polymers16,2491
Non-polymers961
Water181
TypeNameSymmetry operationNumber
identity operation1_555x,y,z1
Unit cell
Length a, b, c (Å)92.310, 105.230, 106.990
Angle α, β, γ (deg.)90.000, 90.000, 90.000
Int Tables number19
Space group name H-MP212121

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Components

#1: Protein
FimA


Mass: 16248.625 Da / Num. of mol.: 8
Source method: isolated from a genetically manipulated source
Source: (gene. exp.) Escherichia coli (E. coli) / Gene: fimA / Production host: Escherichia coli BL21(DE3) (bacteria) / References: UniProt: M4YRT1, UniProt: P04128*PLUS
#2: Chemical
ChemComp-SO4 / SULFATE ION


Mass: 96.063 Da / Num. of mol.: 5 / Source method: obtained synthetically / Formula: SO4
#3: Chemical ChemComp-NA / SODIUM ION


Mass: 22.990 Da / Num. of mol.: 1 / Source method: obtained synthetically / Formula: Na
#4: Chemical ChemComp-ACY / ACETIC ACID


Mass: 60.052 Da / Num. of mol.: 1 / Source method: obtained synthetically / Formula: C2H4O2
#5: Water ChemComp-HOH / water


Mass: 18.015 Da / Num. of mol.: 1962 / Source method: isolated from a natural source / Formula: H2O
Has ligand of interestN
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 Å3/Da / Density % sol: 38.46 %
Crystal growTemperature: 277 K / Method: vapor diffusion, sitting drop / pH: 4.5
Details: 28% PEG 8k, 0.1 M Di-Sodium Acetate pH 4.5 and 0.2 M Lithium Sulfate.

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Data collection

DiffractionMean temperature: 100 K / Serial crystal experiment: N
Diffraction sourceSource: SYNCHROTRON / Site: SLS / Beamline: X10SA / Wavelength: 1 Å
DetectorType: DECTRIS PILATUS 6M-F / Detector: PIXEL / Date: Jun 16, 2018
RadiationMonochromator: SI(111) MONOCHROMATOR / Protocol: SINGLE WAVELENGTH / Monochromatic (M) / Laue (L): M / Scattering type: x-ray
Radiation wavelengthWavelength: 1 Å / Relative weight: 1
ReflectionResolution: 1.5→47.687 Å / Num. obs: 165865 / % possible obs: 100 % / Redundancy: 16.617 % / Biso Wilson estimate: 22.434 Å2 / CC1/2: 0.992 / Rmerge(I) obs: 0.367 / Rrim(I) all: 0.376 / Χ2: 0.817 / Net I/σ(I): 5.87 / Num. measured all: 2756146 / Scaling rejects: 1374
Reflection shell

Diffraction-ID: 1

Resolution (Å)Redundancy (%)Rmerge(I) obsMean I/σ(I) obsNum. measured obsNum. possibleNum. unique obsCC1/2Rrim(I) all% possible all
1.5-1.547.5712.1940.879179512141121250.2762.35399.9
1.54-1.588.1581.8411.099659111851118400.4011.96499.9
1.58-1.638.1741.5711.39445611562115560.4861.67599.9
1.63-1.688.1321.2921.589121711219112170.5851.378100
1.68-1.7310.9261.1472.0511829310830108270.6691.203100
1.73-1.812.4720.8992.8213137910534105340.8010.937100
1.8-1.8611.6790.7583.2711867310161101610.8480.792100
1.86-1.9412.8980.5864.49126309979397930.9080.61100
1.94-2.0315.450.6485.43145552942194210.9320.668100
2.03-2.1224.690.8626.34221663897889780.9340.88100
2.12-2.2426.3330.7777.05225703857185710.950.792100
2.24-2.3726.6750.687.84216256810781070.9560.693100
2.37-2.5426.3930.5868.77201668764176410.9670.597100
2.54-2.7425.4610.4829.78181894714471440.9750.492100
2.74-325.2880.3911.42166094656865680.9830.398100
3-3.3623.5980.29213.17140854596959690.9890.298100
3.36-3.8824.9950.24215.45132650530753070.9920.247100
3.88-4.7524.4980.20117.22110582451445140.9930.205100
4.75-6.7226.8920.17718.9495438354935490.9940.181100
6.72-47.68724.0230.16519.3649079205020430.9860.16999.7

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Phasing

PhasingMethod: molecular replacement

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Processing

Software
NameVersionClassification
XDSdata reduction
XSCALEdata scaling
PHASERphasing
PHENIX1.15-rc3refinement
PDB_EXTRACT3.25data extraction
RefinementMethod to determine structure: MOLECULAR REPLACEMENT
Starting model: 2JTY

2jty


Resolution: 1.502→47.687 Å / SU ML: 0.19 / Cross valid method: THROUGHOUT / σ(F): 1.34 / Phase error: 21.36
RfactorNum. reflection% reflectionSelection details
Rfree0.2058 3318 2 %Random selection
Rwork0.1688 ---
obs0.1696 165836 99.96 %-
Solvent computationShrinkage radii: 0.9 Å / VDW probe radii: 1.11 Å
Displacement parametersBiso max: 110.68 Å2 / Biso mean: 21.3096 Å2 / Biso min: 7.79 Å2
Refinement stepCycle: final / Resolution: 1.502→47.687 Å
ProteinNucleic acidLigandSolventTotal
Num. atoms8991 0 33 1962 10986
Biso mean--57.08 31.11 -
Num. residues----1300
LS refinement shell

Refine-ID: X-RAY DIFFRACTION / Rfactor Rfree error: 0 / Total num. of bins used: 24 / % reflection obs: 100 %

Resolution (Å)Rfactor RfreeNum. reflection RfreeRfactor RworkNum. reflection RworkNum. reflection all
1.502-1.52350.33611370.318666976834
1.5235-1.54620.31651370.300666896826
1.5462-1.57040.33861370.287167026839
1.5704-1.59610.31941360.278466976833
1.5961-1.62360.33251370.276366906827
1.6236-1.65320.30311370.266967306867
1.6532-1.6850.28071370.254867196856
1.685-1.71940.30581370.247766726809
1.7194-1.75670.29461370.238267486885
1.7567-1.79760.25171380.210467496887
1.7976-1.84260.24051380.199567476885
1.8426-1.89240.21321370.181267256862
1.8924-1.94810.21121370.167967406877
1.9481-2.01090.21671380.16867436881
2.0109-2.08280.19331380.15267486886
2.0828-2.16620.21371380.152167696907
2.1662-2.26480.17961380.146567716909
2.2648-2.38420.18181390.148367896928
2.3842-2.53360.20041380.147467956933
2.5336-2.72920.19941390.15268086947
2.7292-3.00380.19911400.147668336973
3.0038-3.43830.16621400.13568667006
3.4383-4.33150.15751410.128569217062
4.3315-47.71080.16351470.151371707317
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)
12.8575-0.0284-0.07983.8445-4.3715.7769-0.1056-0.1391-0.3278-0.0391-0.0952-0.68920.31790.02770.20950.1172-0.0047-0.00440.1040.01190.12621.024-5.8192-26.8595
22.9701-1.5271-0.11956.0867-1.76556.4176-0.2318-1.7602-0.5897-0.2939-0.365-1.36570.16890.13570.58770.34480.02380.01870.77470.19230.682324.747-13.5874-28.5808
32.5999-1.6635-0.56255.78750.56091.38590.11240.05340.1225-0.1945-0.11030.158-0.1421-0.06410.02070.1328-0.0126-0.00740.1511-0.00430.126211.792812.3873-32.1233
41.0737-1.35651.45584.1369-5.12956.6481-0.0594-0.0173-0.01020.01860.0851-0.1435-0.178-0.016-0.07930.10320.00140.00580.1031-0.00330.1298-14.2371-8.951422.398
50.45120.3574-0.49341.6548-2.83384.86930.00650.03240.0141-0.03140.00060.0163-0.09270.0246-0.0220.0991-0.00650.00390.1049-0.00170.1113-8.2507-7.96299.8795
60.78240.0180.35380.5742-0.59721.128-0.04850.0782-0.0253-0.01720.0540.0095-0.04160.0054-0.01740.0795-0.0067-0.00230.0933-0.01720.0872-13.711-11.33767.2533
71.81320.2836-0.2332.8379-1.40284.633-0.016-0.2744-0.4884-0.22550.17620.14840.6166-0.1653-0.120.1431-0.0289-0.00720.13440.03590.1892-17.3491-18.490717.9921
81.22272.4635-1.07586.1939-4.58525.70170.054-0.1158-0.2918-0.1975-0.02150.23320.2157-0.1779-0.13410.11280.00030.00750.16010.03970.2321-19.5323-11.765218.875
95.92935.9877-7.67836.0801-7.79179.98410.374-0.06320.17630.36830.02970.117-0.5321-0.0078-0.42310.14330.0219-0.00090.14790.01160.1172-10.31036.3479-0.6278
100.14390.6556-0.31644.6035-2.86191.9478-0.0491-0.07760.0231-0.45060.09960.02310.2438-0.0137-0.03070.1539-0.0220.00710.1288-0.01540.1395-10.2676-45.0297-8.879
118.77646.3955-3.60798.0321-4.14277.46790.0763-0.1545-0.2630.333-0.1393-0.2-0.0758-0.2410.06060.10970.0170.00210.11680.00440.1022-9.0363-57.76493.9511
120.6740.5023-0.25847.77690.77311.70470.0907-0.07250.2312-0.2460.02690.0401-0.30570.0213-0.06950.1001-0.01780.0470.1081-0.03670.1622-5.9223-28.3011-5.9301
132.3840.97350.09273.0492-0.18360.49660.0112-0.066-0.1289-0.06810.00040.12280.0724-0.09340.00330.0812-0.01140.00830.1247-0.00390.0787-16.8889-47.45591.0626
143.24371.4963-0.31373.26110.252.84630.1075-0.28730.12350.001-0.0821-0.0598-0.02760.0526-0.05750.0930.00510.02150.0765-0.0440.1018-6.9419-29.8051-0.1746
150.93181.3453-0.34144.3842-1.02020.89240.0439-0.0875-0.0760.1053-0.0413-0.00360.03030.0253-0.01320.07540.00130.00940.1122-0.01760.0976-11.1857-50.3109-1.6661
164.23974.18132.24355.52043.4612.5329-0.1342-0.06640.35160.1715-0.02730.542-0.0068-0.0920.21290.0899-0.00530.01710.0971-0.01190.0956-16.1735-34.9757-3.5933
170.4098-0.1251-0.25773.91093.54063.2534-0.1179-0.1270.2339-0.1971-0.0460.2012-0.3108-0.1910.20540.16340.0446-0.03050.1573-0.03770.1989-15.6022-33.7247-5.0589
185.512-3.83720.4975.1586-0.62270.08680.21180.0326-0.3408-0.8342-0.2786-0.31140.230.35450.06050.3715-0.01220.01160.19040.01450.2231-11.805-62.0959-8.0093
190.1744-0.6656-0.34058.00765.25053.51390.0052-0.0390.06360.379-0.0182-0.14870.2236-0.0195-0.00030.1106-0.0147-0.01180.13680.01090.14743.35037.835810.9516
204.6409-4.5998-4.33244.94213.98384.4798-0.1213-0.1153-0.1780.0209-0.09160.1330.22520.33010.20750.1125-0.02350.00570.1349-0.00170.10932.35470.187-5.2883
211.36490.25520.61224.82444.27894.212-0.04-0.03930.19810.09160.031-0.0421-0.14560.06680.03320.0673-0.0129-0.0150.1346-0.00740.14280.026724.802213.5543
220.9242-0.9111-0.24022.67920.9910.87820.02550.06650.0464-0.0634-0.0707-0.133-0.04740.03940.02240.0926-0.02490.00370.10650.02560.11696.790112.26162.7956
231.5324-1.0956-0.31943.24041.73990.98830.027-0.05860.03040.05080.0825-0.3155-0.02750.0669-0.09270.1088-0.03270.01390.12050.01090.128510.0038.32695.295
241.46520.6881-0.74034.8797-2.33231.23970.00120.1140.2556-0.2071-0.1042-0.241-0.45880.32670.26890.2609-0.0598-0.04310.19010.0260.19189.283512.936811.6031
256.1368-1.0144-1.52365.37754.55464.6218-0.03470.1622-0.63750.68890.03560.27740.306-0.44480.07230.24650.0049-0.02950.1830.05920.18973.8704-9.59324.0869
261.25050.0948-0.34740.7198-0.23635.44860.0973-0.0174-0.0750.07410.05590.0439-0.4345-0.1263-0.12320.085-0.0139-0.00260.13260.00630.1318-3.4049-4.0851-37.8565
270.7476-0.01510.23180.7144-0.48812.3823-0.01060.0398-0.064-0.08530.04040.06850.1474-0.1497-0.0340.1272-0.0372-0.00520.13540.0090.1333-5.1838-12.7832-40.2871
283.1082-1.2515-0.72982.1727-0.61720.66880.22620.0904-0.3034-0.0092-0.00230.05820.2599-0.3598-0.22390.1574-0.063-0.01130.1730.06030.12510.4672-18.1991-27.1003
291.2929-0.09130.00020.7399-0.6212.3447-0.00680.0267-0.0494-0.0276-0.00180.03620.0504-0.1497-0.00170.1079-0.0439-0.00440.10190.00650.1046-5.0809-10.7103-40.2745
303.79-0.93121.31952.5071-0.91763.34510.1705-0.1829-0.1537-0.27890.33310.3852-0.3421-0.6593-0.54340.32540.07410.09420.35480.08360.4676-10.3041-20.3687-23.7923
313.14061.2481-1.48525.2022-3.23262.82280.1310.14210.064-0.05810.05180.0695-0.213-0.2626-0.23960.1002-0.0026-0.0020.12730.01980.1248-7.3426-1.4716-45.0773
320.0223-0.0585-0.27331.48683.35868.4797-0.00080.0306-0.0727-0.0313-0.0168-0.0702-0.1401-0.2171-0.02360.1263-0.01590.01480.1236-0.00720.1574-33.1807-8.1719-35.7558
337.9292-0.02394.75343.9938-0.0757.01940.0905-0.2466-0.23470.6134-0.0175-0.01650.3269-0.0946-0.09370.18260.02040.01010.13550.02590.1186-34.6326-10.3394-17.8489
340.72950.04610.30791.85591.24492.03420.0126-0.0543-0.04540.1250.06-0.18920.14280.0193-0.08770.1056-0.00620.0060.09180.01390.1288-29.5359-15.6022-33.1129
352.7472.66962.45156.33124.50674.06810.15110.2348-0.42030.45480.2567-0.51840.48760.1124-0.36020.16410.00920.02160.1498-0.01530.1822-25.1263-18.4835-40.2596
360.1156-0.37990.06781.5754-0.55220.3796-0.07310.3236-0.4826-0.20970.0957-0.42220.35410.5034-0.30350.21240.05040.07810.2498-0.12380.3161-24.9357-14.4534-42.1609
373.8453-3.6645-3.1455.22684.97764.8319-0.0517-0.09120.046-0.0244-0.06160.147-0.365-0.47990.05380.179-0.006-0.01070.167-0.00330.1657-34.94632.2363-21.4255
383.17790.64481.10065.9692-3.37116.87080.09170.02960.0557-0.2141-0.2541-0.1262-0.00990.3740.1680.073-0.01010.03430.16770.02720.17478.5626-13.405514.0809
393.6908-3.575-3.90573.88844.43135.120.1270.3011-0.1569-0.3942-0.36440.283-0.3661-0.22060.16970.2285-0.0115-0.02940.13540.00050.13370.29767.395725.4823
403.56061.85363.4884.52284.14276.1774-0.06240.09390.12090.06760.00770.2229-0.03740.26860.0640.1395-0.0208-0.01110.1530.00050.1056-0.75826.637737.5961
411.1729-1.4144-0.57424.57881.9752.30930.03310.0983-0.0422-0.1826-0.1017-0.14460.04630.01160.07620.08430.00010.01710.0985-0.00040.11194.2089-17.315117.92
420.48290.0123-0.14882.02721.8331.7727-0.0772-0.06440.01590.00670.0690.0430.0480.1240.0120.0946-0.0067-0.01090.13490.01510.092811.5238-4.376732.5389
433.60070.795-1.76315.9824-3.58776.50920.00680.45310.4243-0.38720.0636-0.2326-0.17490.1785-0.04650.1202-0.045-0.01890.18060.03370.143111.015511.673829.5423
440.71110.83850.32291.73790.74620.76810.0254-0.0771-0.01520.1151-0.10110.0290.04040.00830.06150.0905-0.0027-0.0060.10720.00940.10025.2599-11.031628.8647
450.1260.1982-0.09282.23771.28661.1149-0.02680.00430.0406-0.056-0.02970.1104-0.0844-0.01830.06080.0888-0.0009-0.01720.104-0.00120.10463.09142.424629.7642
463.0467-0.61950.48194.6523.62493.4418-0.1413-0.1031-0.31840.0870.3272-0.19350.03980.1375-0.12770.04340.01430.01280.1255-0.01010.094811.6916-10.829123.6443
474.9903-2.7248-2.40123.4821-1.82286.0796-0.3157-0.0249-0.00891.04350.0804-1.26950.33690.08960.18280.44740.1421-0.03210.4179-0.08320.294917.9357-16.095619.2891
483.7077-3.1801-3.55466.76424.52844.73170.27650.18750.0751-0.6186-0.30720.2588-0.49-0.23110.06670.1934-0.0068-0.05450.1653-0.01610.13683.8998.669424.6106
490.5415-0.02181.51740.18990.55149.21380.0398-0.03890.03320.00650.0028-0.02720.2849-0.0192-0.04650.0877-0.01520.02110.1316-0.0220.13265.6033-43.6935-16.4286
508.18562.0437-6.08736.9001-0.30764.81460.05480.03020.0917-0.2779-0.1311-0.1752-0.21910.04060.07510.0691-0.0115-0.02350.10310.01320.0883.3053-35.9135-32.1135
510.94930.0095-0.42620.58920.07723.58070.0253-0.10880.126-0.0016-0.0096-0.0174-0.09120.1018-0.02180.0796-0.00710.00350.0894-0.02020.110210.8531-34.4094-10.2025
520.4736-0.1216-0.20320.52010.75442.42680.00770.04220.05150.0331-0.0060.01120.0598-0.033-0.02380.0733-0.02580.01660.1109-0.00850.09829.0135-36.947-19.8586
533.40360.3843-0.56564.55183.23455.2263-0.0001-0.14020.3598-0.21070.2907-0.2207-0.47880.3832-0.24910.1007-0.01510.01030.1328-0.00210.155914.7422-35.8838-9.2323
541.4752-0.20131.49550.1150.25133.78980.0234-0.08860.11910.0066-0.0469-0.00790.0828-0.0432-0.0320.1244-0.02280.00780.14390.01050.151410.1993-43.6365-17.664
553.2971-0.5192-2.28992.062.33926.43970.0014-0.04570.204-0.10850.1724-0.1268-0.1659-0.0751-0.09640.14920.00990.02960.09870.02290.170917.694-11.0747-35.0808
565.5081-5.7508-4.68246.38975.49234.99220.16330.1131-0.0912-0.4213-0.23850.2108-0.1628-0.16680.04590.1502-0.0156-0.00290.12370.00070.11448.335511.5208-30.6317
573.84864.03564.12634.31174.59825.77040.0446-0.0002-0.04910.3550.09750.1620.16860.0721-0.14260.10050.00620.01370.15-0.01080.1147.526114.3693-18.9642
582.2905-2.94320.70965.7429-0.34871.11240.1670.0224-0.0685-0.2773-0.1122-0.11310.1493-0.0064-0.05460.1266-0.00350.01570.0980.0160.12513.8346-13.9732-30.2069
591.91750.5185-0.41454.84110.20151.8963-0.0019-0.19650.07890.2544-0.0187-0.12270.00890.08170.02070.0797-0.0127-0.02630.14680.00930.111720.25823.0135-20.4464
604.4842-0.2197-1.52328.6177-3.13954.48250.09920.27570.3028-0.3946-0.1523-0.498-0.04050.08920.0360.0809-0.00920.00230.1669-0.0060.17618.883617.3074-28.2291
610.6791-0.2018-0.01641.7866-0.02020.53620.0382-0.0997-0.01360.0168-0.06360.04510.0518-0.02430.02850.0787-0.0197-0.00380.10860.00390.078413.13260.7789-23.1026
Refinement TLS group
IDRefine-IDRefine TLS-IDSelection detailsAuth asym-IDAuth seq-ID
1X-RAY DIFFRACTION1chain 'H' and (resid 132 through 141 )H132 - 141
2X-RAY DIFFRACTION2chain 'H' and (resid 142 through 152 )H142 - 152
3X-RAY DIFFRACTION3chain 'H' and (resid 153 through 166 )H153 - 166
4X-RAY DIFFRACTION4chain 'F' and (resid 1 through 14 )F1 - 14
5X-RAY DIFFRACTION5chain 'F' and (resid 15 through 47 )F15 - 47
6X-RAY DIFFRACTION6chain 'F' and (resid 48 through 131 )F48 - 131
7X-RAY DIFFRACTION7chain 'F' and (resid 132 through 145 )F132 - 145
8X-RAY DIFFRACTION8chain 'F' and (resid 146 through 157 )F146 - 157
9X-RAY DIFFRACTION9chain 'F' and (resid 158 through 166 )F158 - 166
10X-RAY DIFFRACTION10chain 'A' and (resid 1 through 23 )A1 - 23
11X-RAY DIFFRACTION11chain 'A' and (resid 24 through 33 )A24 - 33
12X-RAY DIFFRACTION12chain 'A' and (resid 34 through 50 )A34 - 50
13X-RAY DIFFRACTION13chain 'A' and (resid 51 through 96 )A51 - 96
14X-RAY DIFFRACTION14chain 'A' and (resid 97 through 110 )A97 - 110
15X-RAY DIFFRACTION15chain 'A' and (resid 111 through 131 )A111 - 131
16X-RAY DIFFRACTION16chain 'A' and (resid 132 through 140 )A132 - 140
17X-RAY DIFFRACTION17chain 'A' and (resid 141 through 157 )A141 - 157
18X-RAY DIFFRACTION18chain 'A' and (resid 158 through 166 )A158 - 166
19X-RAY DIFFRACTION19chain 'B' and (resid 1 through 23 )B1 - 23
20X-RAY DIFFRACTION20chain 'B' and (resid 24 through 33 )B24 - 33
21X-RAY DIFFRACTION21chain 'B' and (resid 34 through 50 )B34 - 50
22X-RAY DIFFRACTION22chain 'B' and (resid 51 through 121 )B51 - 121
23X-RAY DIFFRACTION23chain 'B' and (resid 122 through 140 )B122 - 140
24X-RAY DIFFRACTION24chain 'B' and (resid 141 through 158 )B141 - 158
25X-RAY DIFFRACTION25chain 'B' and (resid 159 through 166 )B159 - 166
26X-RAY DIFFRACTION26chain 'C' and (resid 1 through 23 )C1 - 23
27X-RAY DIFFRACTION27chain 'C' and (resid 24 through 96 )C24 - 96
28X-RAY DIFFRACTION28chain 'C' and (resid 97 through 110 )C97 - 110
29X-RAY DIFFRACTION29chain 'C' and (resid 111 through 141 )C111 - 141
30X-RAY DIFFRACTION30chain 'C' and (resid 142 through 152 )C142 - 152
31X-RAY DIFFRACTION31chain 'C' and (resid 153 through 164 )C153 - 164
32X-RAY DIFFRACTION32chain 'D' and (resid 1 through 23 )D1 - 23
33X-RAY DIFFRACTION33chain 'D' and (resid 24 through 33 )D24 - 33
34X-RAY DIFFRACTION34chain 'D' and (resid 34 through 131 )D34 - 131
35X-RAY DIFFRACTION35chain 'D' and (resid 132 through 141 )D132 - 141
36X-RAY DIFFRACTION36chain 'D' and (resid 142 through 157 )D142 - 157
37X-RAY DIFFRACTION37chain 'D' and (resid 158 through 166 )D158 - 166
38X-RAY DIFFRACTION38chain 'E' and (resid 1 through 10 )E1 - 10
39X-RAY DIFFRACTION39chain 'E' and (resid 11 through 23 )E11 - 23
40X-RAY DIFFRACTION40chain 'E' and (resid 24 through 33 )E24 - 33
41X-RAY DIFFRACTION41chain 'E' and (resid 34 through 49 )E34 - 49
42X-RAY DIFFRACTION42chain 'E' and (resid 50 through 66 )E50 - 66
43X-RAY DIFFRACTION43chain 'E' and (resid 67 through 80 )E67 - 80
44X-RAY DIFFRACTION44chain 'E' and (resid 81 through 110 )E81 - 110
45X-RAY DIFFRACTION45chain 'E' and (resid 111 through 131 )E111 - 131
46X-RAY DIFFRACTION46chain 'E' and (resid 132 through 141 )E132 - 141
47X-RAY DIFFRACTION47chain 'E' and (resid 142 through 152 )E142 - 152
48X-RAY DIFFRACTION48chain 'E' and (resid 153 through 166 )E153 - 166
49X-RAY DIFFRACTION49chain 'G' and (resid 1 through 23 )G1 - 23
50X-RAY DIFFRACTION50chain 'G' and (resid 24 through 33 )G24 - 33
51X-RAY DIFFRACTION51chain 'G' and (resid 34 through 66 )G34 - 66
52X-RAY DIFFRACTION52chain 'G' and (resid 67 through 131 )G67 - 131
53X-RAY DIFFRACTION53chain 'G' and (resid 132 through 141 )G132 - 141
54X-RAY DIFFRACTION54chain 'G' and (resid 142 through 166 )G142 - 166
55X-RAY DIFFRACTION55chain 'H' and (resid 1 through 10 )H1 - 10
56X-RAY DIFFRACTION56chain 'H' and (resid 11 through 23 )H11 - 23
57X-RAY DIFFRACTION57chain 'H' and (resid 24 through 33 )H24 - 33
58X-RAY DIFFRACTION58chain 'H' and (resid 34 through 49 )H34 - 49
59X-RAY DIFFRACTION59chain 'H' and (resid 50 through 66 )H50 - 66
60X-RAY DIFFRACTION60chain 'H' and (resid 67 through 80 )H67 - 80
61X-RAY DIFFRACTION61chain 'H' and (resid 81 through 131 )H81 - 131

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