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- PDB-6ra9: Novel structural features and post-translational modifications in... -

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Basic information

Entry
Database: PDB / ID: 6ra9
TitleNovel structural features and post-translational modifications in eukaryotic elongation factor 1A2 from Oryctolagus cuniculus
Components(Elongation factor 1-alpha ...) x 2
KeywordsTRANSLATION / Moonlighting protein / RNA binding protein / posttranslational modifications / protein binding / oncoprotein
Function / homology
Function and homology information


translation elongation factor activity / GTPase activity / GTP binding / nucleus
Similarity search - Function
Translation elongation factor EF1A, eukaryotic/archaeal / GTP-eEF1A C-terminal domain-like / : / Elongation factor Tu C-terminal domain / Translation elongation factor EF1A/initiation factor IF2gamma, C-terminal / Tr-type G domain, conserved site / Translational (tr)-type guanine nucleotide-binding (G) domain signature. / Translation elongation factor EFTu-like, domain 2 / Elongation factor Tu domain 2 / Translational (tr)-type GTP-binding domain ...Translation elongation factor EF1A, eukaryotic/archaeal / GTP-eEF1A C-terminal domain-like / : / Elongation factor Tu C-terminal domain / Translation elongation factor EF1A/initiation factor IF2gamma, C-terminal / Tr-type G domain, conserved site / Translational (tr)-type guanine nucleotide-binding (G) domain signature. / Translation elongation factor EFTu-like, domain 2 / Elongation factor Tu domain 2 / Translational (tr)-type GTP-binding domain / Elongation factor Tu GTP binding domain / Translational (tr)-type guanine nucleotide-binding (G) domain profile. / Translation protein, beta-barrel domain superfamily / P-loop containing nucleoside triphosphate hydrolase
Similarity search - Domain/homology
GUANOSINE-5'-DIPHOSPHATE / L-ALPHA-GLYCEROPHOSPHORYLETHANOLAMINE / Elongation factor 1-alpha 2
Similarity search - Component
Biological speciesOryctolagus cuniculus (rabbit)
MethodX-RAY DIFFRACTION / SYNCHROTRON / MOLECULAR REPLACEMENT / Resolution: 2.7 Å
AuthorsCarriles, A.A. / Hermoso, J. / Gago, F.
Funding support Spain, 1items
OrganizationGrant numberCountry
Spanish Ministry of Science, Innovation, and UniversitiesSAF2015-64629-C2-2-R Spain
CitationJournal: Chembiochem / Year: 2021
Title: Structural Cues for Understanding eEF1A2 Moonlighting.
Authors: Carriles, A.A. / Mills, A. / Munoz-Alonso, M.J. / Gutierrez, D. / Dominguez, J.M. / Hermoso, J.A. / Gago, F.
History
DepositionApr 5, 2019Deposition site: PDBE / Processing site: PDBE
Revision 1.0Jun 3, 2020Provider: repository / Type: Initial release
Revision 1.1Apr 7, 2021Group: Database references / Category: citation / citation_author
Item: _citation.country / _citation.journal_abbrev ..._citation.country / _citation.journal_abbrev / _citation.journal_id_CSD / _citation.journal_id_ISSN / _citation.journal_volume / _citation.page_first / _citation.page_last / _citation.pdbx_database_id_DOI / _citation.pdbx_database_id_PubMed / _citation.title / _citation.year / _citation_author.identifier_ORCID / _citation_author.name
Revision 1.2Jan 24, 2024Group: Data collection / Database references ...Data collection / Database references / Derived calculations / Refinement description
Category: chem_comp_atom / chem_comp_bond ...chem_comp_atom / chem_comp_bond / database_2 / pdbx_initial_refinement_model / struct_conn
Item: _database_2.pdbx_DOI / _database_2.pdbx_database_accession / _struct_conn.pdbx_leaving_atom_flag

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Structure visualization

Structure viewerMolecule:
MolmilJmol/JSmol

Downloads & links

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Assembly

Deposited unit
A: Elongation factor 1-alpha 2
B: Elongation factor 1-alpha 2
hetero molecules


Theoretical massNumber of molelcules
Total (without water)103,32524
Polymers100,1842
Non-polymers3,14122
Water2,108117
1


  • Idetical with deposited unit
  • defined by author&software
  • Evidence: mass spectrometry
TypeNameSymmetry operationNumber
identity operation1_555x,y,z1
Buried area10130 Å2
ΔGint-181 kcal/mol
Surface area36280 Å2
MethodPISA
Unit cell
Length a, b, c (Å)133.520, 133.520, 305.440
Angle α, β, γ (deg.)90.000, 90.000, 120.000
Int Tables number178
Space group name H-MP6122
Space group name HallP612(x,y,z+5/12)

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Components

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Elongation factor 1-alpha ... , 2 types, 2 molecules AB

#1: Protein Elongation factor 1-alpha 2 / EF-1-alpha-2 / Eukaryotic elongation factor 1 A-2 / eEF1A-2 / Statin-S1


Mass: 49768.020 Da / Num. of mol.: 1 / Source method: isolated from a natural source / Source: (natural) Oryctolagus cuniculus (rabbit) / References: UniProt: Q71V39
#2: Protein Elongation factor 1-alpha 2 / EF-1-alpha-2 / Eukaryotic elongation factor 1 A-2 / eEF1A-2 / Statin-S1


Mass: 50415.898 Da / Num. of mol.: 1 / Source method: isolated from a natural source / Source: (natural) Oryctolagus cuniculus (rabbit) / References: UniProt: Q71V39

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Non-polymers , 5 types, 139 molecules

#3: Chemical ChemComp-GPE / L-ALPHA-GLYCEROPHOSPHORYLETHANOLAMINE


Mass: 215.142 Da / Num. of mol.: 3 / Source method: obtained synthetically / Formula: C5H14NO6P
#4: Chemical ChemComp-GDP / GUANOSINE-5'-DIPHOSPHATE


Type: RNA linking / Mass: 443.201 Da / Num. of mol.: 2 / Source method: obtained synthetically / Formula: C10H15N5O11P2 / Comment: GDP, energy-carrying molecule*YM
#5: Chemical
ChemComp-GOL / GLYCEROL / GLYCERIN / PROPANE-1,2,3-TRIOL


Mass: 92.094 Da / Num. of mol.: 6 / Source method: obtained synthetically / Formula: C3H8O3
#6: Chemical
ChemComp-SO4 / SULFATE ION


Mass: 96.063 Da / Num. of mol.: 11 / Source method: obtained synthetically / Formula: SO4
#7: Water ChemComp-HOH / water


Mass: 18.015 Da / Num. of mol.: 117 / Source method: isolated from a natural source / Formula: H2O

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Details

Has ligand of interestY

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Experimental details

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Experiment

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

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Sample preparation

CrystalDensity Matthews: 3.92 Å3/Da / Density % sol: 68.6 %
Crystal growTemperature: 291 K / Method: vapor diffusion, hanging drop
Details: 50 mM Na citrate pH 5/MES pH 5.6, 2.2-2.6 M ammonium sulphate, 10 mM Mg acetate

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Data collection

DiffractionMean temperature: 80 K / Serial crystal experiment: N
Diffraction sourceSource: SYNCHROTRON / Site: ALBA / Beamline: XALOC / Wavelength: 0.97926 Å
DetectorType: DECTRIS PILATUS3 S 6M / Detector: PIXEL / Date: Nov 17, 2015
RadiationProtocol: SINGLE WAVELENGTH / Monochromatic (M) / Laue (L): M / Scattering type: x-ray
Radiation wavelengthWavelength: 0.97926 Å / Relative weight: 1
ReflectionResolution: 2.7→61.17 Å / Num. obs: 83606 / % possible obs: 100 % / Redundancy: 13 % / Biso Wilson estimate: 60.78 Å2 / CC1/2: 0.995 / Rmerge(I) obs: 0.12 / Rpim(I) all: 0.034 / Rrim(I) all: 0.125 / Net I/σ(I): 12.3
Reflection shell

Diffraction-ID: 1

Resolution (Å)Redundancy (%)Rmerge(I) obsNum. unique obsCC1/2Rpim(I) allRrim(I) all% possible all
2.7-2.7911.21.06943390.840.321.118100
2.7-2.79712.30.0529410.9840.0160.05599.5

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Processing

Software
NameVersionClassification
PHENIX1.17.1_3660refinement
PHENIX1.17.1_3660refinement
MOSFLMdata reduction
Aimlessdata scaling
MOLREPphasing
RefinementMethod to determine structure: MOLECULAR REPLACEMENT
Starting model: 4C0S
Resolution: 2.7→57.82 Å / SU ML: 0.4198 / Cross valid method: FREE R-VALUE / σ(F): 1.91 / Phase error: 24.302
Stereochemistry target values: GeoStd + Monomer Library + CDL v1.2
RfactorNum. reflection% reflectionSelection details
Rfree0.2241 4337 5.19 %RANDOM
Rwork0.1788 79269 --
obs0.1811 83606 99.91 %-
Solvent computationShrinkage radii: 0.9 Å / VDW probe radii: 1.11 Å / Solvent model: FLAT BULK SOLVENT MODEL
Displacement parametersBiso mean: 78.08 Å2
Refinement stepCycle: LAST / Resolution: 2.7→57.82 Å
ProteinNucleic acidLigandSolventTotal
Num. atoms6936 0 55 117 7108
Refine LS restraints
Refine-IDTypeDev idealNumber
X-RAY DIFFRACTIONf_bond_d0.00277132
X-RAY DIFFRACTIONf_angle_d0.63479698
X-RAY DIFFRACTIONf_chiral_restr0.04741090
X-RAY DIFFRACTIONf_plane_restr0.00481231
X-RAY DIFFRACTIONf_dihedral_angle_d20.1932561
LS refinement shell
Resolution (Å)Rfactor RfreeNum. reflection RfreeRfactor RworkNum. reflection RworkRefine-ID% reflection obs (%)
2.7-2.730.3651520.32872659X-RAY DIFFRACTION99.65
2.73-2.760.40161390.33262615X-RAY DIFFRACTION99.75
2.76-2.80.38421360.31932671X-RAY DIFFRACTION99.72
2.8-2.830.31351550.30442633X-RAY DIFFRACTION100
2.83-2.870.3451070.29742650X-RAY DIFFRACTION99.75
2.87-2.910.31141640.30152634X-RAY DIFFRACTION99.86
2.91-2.950.34731500.27922635X-RAY DIFFRACTION99.79
2.95-2.990.26741430.25952630X-RAY DIFFRACTION99.78
2.99-3.040.32951280.26352675X-RAY DIFFRACTION99.96
3.04-3.090.27751740.25062616X-RAY DIFFRACTION99.86
3.09-3.140.29351480.2522609X-RAY DIFFRACTION99.96
3.14-3.20.31241530.24342637X-RAY DIFFRACTION99.93
3.2-3.260.30621360.23672659X-RAY DIFFRACTION99.89
3.26-3.330.271450.23222641X-RAY DIFFRACTION99.96
3.33-3.40.28551550.21252649X-RAY DIFFRACTION100
3.4-3.480.24551300.18042629X-RAY DIFFRACTION100
3.48-3.570.17941540.17442635X-RAY DIFFRACTION99.89
3.57-3.660.17161380.15552641X-RAY DIFFRACTION99.96
3.66-3.770.17741460.15432660X-RAY DIFFRACTION99.96
3.77-3.890.18561200.15232655X-RAY DIFFRACTION100
3.89-4.030.17981420.1432661X-RAY DIFFRACTION100
4.03-4.190.18321900.12632597X-RAY DIFFRACTION99.96
4.19-4.390.19081660.12872606X-RAY DIFFRACTION100
4.39-4.620.18251420.12182681X-RAY DIFFRACTION100
4.62-4.90.15171380.1172644X-RAY DIFFRACTION100
4.91-5.280.20461490.13542614X-RAY DIFFRACTION100
5.28-5.810.1891450.1562661X-RAY DIFFRACTION100
5.82-6.650.22121440.16642645X-RAY DIFFRACTION100
6.66-8.380.20821310.17972649X-RAY DIFFRACTION100
8.38-57.820.2261170.17362678X-RAY DIFFRACTION99.75
Refinement TLS params.

Method: refined / Refine-ID: X-RAY DIFFRACTION

IDL112)L122)L132)L222)L232)L332)S11 (Å °)S12 (Å °)S13 (Å °)S21 (Å °)S22 (Å °)S23 (Å °)S31 (Å °)S32 (Å °)S33 (Å °)T112)T122)T132)T222)T232)T332)Origin x (Å)Origin y (Å)Origin z (Å)
17.35616850523-1.181385357382.342181694692.189164585531.009213102216.53657293694-0.0816461168562-0.0763722048532-0.0239144181995-0.36955483085-0.02051382443160.3868228057440.210288032432-0.7278831064060.05836907741380.793922233178-0.1934405750780.1020343573880.375013483187-0.0672618267550.53535851988747.28696193413.27568941236-35.898606812
24.13866361248-0.203827061991.982181650088.98595027161.152173013384.2571982778-0.09926298036350.1329818223220.248213481598-0.08023430899130.0608266077664-0.7848492239840.3132220674560.1577160892580.03288865544970.624789488378-0.04866611080780.06803629933070.2898030469050.02734316818940.435411230863.52065235722.66447536173-33.2314901593
34.634381588140.6756575724121.617983718044.86915690390.4711580722633.00275893996-0.137500261089-0.284310221027-0.2751194794270.4533886377530.143606278511-0.1730830383381.16013809160.0313578741824-0.0138102799061.08654366942-0.02463549800750.09196486228630.373211117276-0.01614173436180.47269617573162.1560306601-9.47152718781-28.0120542423
43.57931414517-1.16013757579-0.8436088121172.590476848324.109887828978.18002514954-0.255663939022-0.161075010028-0.1280189641781.62578295030.1364995312640.5033843584460.622926746596-0.8112209532360.09467358500410.7449306551270.008493794776470.04503139534070.4064824555610.03834990169230.53132914989956.146634413721.904343652-0.0889146708292
55.919817816080.782393775786-2.776303341158.205020993560.3527513432837.04711656645-0.403563435092-0.0202252261986-0.2419623931121.20124928210.4584088347760.5210471272010.783012807733-0.952460024276-0.03003359220280.989706104055-0.04697526237670.05110608751250.5804329572470.07766379793550.38450596170755.543326644517.83675748885.02819487333
69.03163924809-2.32768668119-2.821549112037.56587748564-0.2596886678644.184266167120.189584278129-0.701659583667-0.1723762236711.377044541190.0276840137615-0.5796097642530.4728703531780.50421778018-0.1271177700040.7930673473650.0341055795599-0.1371265136690.451903174393-0.01530832916160.45094678836463.392938244922.78626375352.08474886835
74.778283253530.681286575431-1.791613871484.765736157383.106181126019.36446826213-0.1946522566550.230613892606-0.109231461902-0.7618123753880.280737376061-0.728764797803-0.449261541660.466729791022-0.07022928763330.581802683315-0.01054745212780.088266439440.3011055335810.04655443388170.52471857813369.788568956223.6413504035-25.7158270652
84.984205656830.0935643885456-2.693073648114.72794320531.49671282953.942158841350.103442817076-0.540762637248-0.1670603256250.400282697163-0.0807286760632-0.5569908367390.2369216686150.5811736340940.001531678681330.458407108051-0.0434332589336-0.04452713154020.366856993998-0.02081656950070.50589592615768.143548328222.0489407226-16.714110482
97.170801940751.160440291683.08672493984.161588568940.005167522909654.41017707996-0.125621615565-0.280980032569-0.3085212382860.6702823216880.210486229809-0.3482211514550.194179974865-0.178295413019-0.02296388145370.5476923299960.1002854714140.08480289089860.384109149698-0.007568478264470.36712224463548.525190078538.7872486734-10.5673929678
103.50082358318-1.76333639678-0.8522957597639.051648435132.845711301165.06216696037-0.189274727244-0.144741537864-0.231016173392-0.1304436377620.484360039058-0.4081424007270.2453517125250.262225769827-0.0755864113820.4594846953720.109133439728-0.01612578476640.571876292285-0.00558405793020.3602663903449.139724094434.345654869-14.4303563332
112.72724985351-1.45024695711-1.422950941684.238017763722.021061319055.80441707046-0.05750242345640.0292028113478-0.1764691495390.05986365803730.05289552076530.610423446176-0.0297782614183-0.692024108265-0.008626011296560.2872965069030.02621848931520.05719668792210.4499853470030.09856485693780.40901824701632.014427734843.2678613298-16.9478238462
120.05130458125990.3447845224410.516163396948.293996161438.325957391868.67442530664-0.2003684523420.0828560677429-0.652154239811.31910576574-0.06238782960840.758870440651.32679508505-0.8513069480550.2440303791150.685986680509-0.08656775105080.2114454704840.6810817279790.1003580078720.82292129900228.237860202725.8711668719-13.2208679171
133.691396944741.60293473817-0.6804782621068.52940433491-1.056578979272.94977017288-0.131115308319-0.211236458772-1.11590102553-0.478808312157-0.1612906482521.915151453740.958913767294-0.893337245650.2543583911250.811092745882-0.2618253521740.06693730687940.755170593594-0.06951418396641.415864409525.05001760425.76734356255-30.5259707771
143.214217242412.322008544410.5153413838913.148516708660.737983772747.48077075546-0.07467124418670.661516880076-0.0925419837583-1.79803410492-0.1426913532480.55977981568-0.522252870189-0.4298470228030.114561622550.896908916030.0329207021128-0.1220374194080.667661116896-0.002050743711990.59680048066538.165144282129.2932719204-41.941211693
154.646520274722.03180154732-0.05030880187045.99903682688-0.2819046320614.26711703133-0.03258655093580.562589794519-0.377053716654-1.183256463540.1131620763221.153793383730.312047402426-0.7358321062150.06854869279730.73105214578-0.0753972517433-0.248877092740.553834569599-0.117798894370.80422749661929.150897712619.9639737575-37.931050665
Refinement TLS group
IDRefine-IDRefine TLS-IDSelection details
1X-RAY DIFFRACTION1chain 'A' and (resid 5 through 92 )
2X-RAY DIFFRACTION2chain 'A' and (resid 93 through 163 )
3X-RAY DIFFRACTION3chain 'A' and (resid 164 through 240 )
4X-RAY DIFFRACTION4chain 'A' and (resid 241 through 269 )
5X-RAY DIFFRACTION5chain 'A' and (resid 270 through 306 )
6X-RAY DIFFRACTION6chain 'A' and (resid 307 through 336 )
7X-RAY DIFFRACTION7chain 'A' and (resid 337 through 389 )
8X-RAY DIFFRACTION8chain 'A' and (resid 390 through 454 )
9X-RAY DIFFRACTION9chain 'B' and (resid 4 through 48 )
10X-RAY DIFFRACTION10chain 'B' and (resid 49 through 92 )
11X-RAY DIFFRACTION11chain 'B' and (resid 93 through 222 )
12X-RAY DIFFRACTION12chain 'B' and (resid 223 through 249 )
13X-RAY DIFFRACTION13chain 'B' and (resid 250 through 346 )
14X-RAY DIFFRACTION14chain 'B' and (resid 347 through 389 )
15X-RAY DIFFRACTION15chain 'B' and (resid 390 through 461 )

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