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- PDB-1zh5: Structural basis for recognition of UUUOH 3'-terminii of nascent ... -

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Basic information

Entry
Database: PDB / ID: 1zh5
TitleStructural basis for recognition of UUUOH 3'-terminii of nascent RNA pol III transcripts by La autoantigen
Components
  • 5'-R(*UP*GP*CP*UP*GP*UP*UP*UP*U)-3'
  • Lupus La protein
KeywordsTRANSCRIPTION/RNA / TRANSCRIPTION-RNA complex
Function / homology
Function and homology information


nuclear histone mRNA catabolic process / histone mRNA metabolic process / tRNA 3'-end processing / protein localization to cytoplasmic stress granule / RNA Polymerase III Transcription Termination / IRES-dependent viral translational initiation / tRNA export from nucleus / RNA Polymerase III Abortive And Retractive Initiation / tRNA 5'-leader removal / tRNA modification ...nuclear histone mRNA catabolic process / histone mRNA metabolic process / tRNA 3'-end processing / protein localization to cytoplasmic stress granule / RNA Polymerase III Transcription Termination / IRES-dependent viral translational initiation / tRNA export from nucleus / RNA Polymerase III Abortive And Retractive Initiation / tRNA 5'-leader removal / tRNA modification / sequence-specific mRNA binding / poly(U) RNA binding / tRNA processing / positive regulation of translation / cytoplasmic stress granule / tRNA binding / chromosome, telomeric region / ribonucleoprotein complex / mRNA binding / RNA binding / nucleus / cytosol / cytoplasm
Similarity search - Function
RNA binding motif / Lupus La protein / La protein, xRRM domain / xRRM domain profile. / La domain containing protein / La domain / Domain in the RNA-binding Lupus La protein; unknown function / La-type HTH domain / La-type HTH domain profile. / RRM (RNA recognition motif) domain ...RNA binding motif / Lupus La protein / La protein, xRRM domain / xRRM domain profile. / La domain containing protein / La domain / Domain in the RNA-binding Lupus La protein; unknown function / La-type HTH domain / La-type HTH domain profile. / RRM (RNA recognition motif) domain / Winged helix-like DNA-binding domain superfamily/Winged helix DNA-binding domain / RNA recognition motif / RNA recognition motif / Eukaryotic RNA Recognition Motif (RRM) profile. / RNA recognition motif domain / RNA-binding domain superfamily / Arc Repressor Mutant, subunit A / Winged helix DNA-binding domain superfamily / Nucleotide-binding alpha-beta plait domain superfamily / Alpha-Beta Plaits / Winged helix-like DNA-binding domain superfamily / 2-Layer Sandwich / Orthogonal Bundle / Mainly Alpha / Alpha Beta
Similarity search - Domain/homology
RNA / Lupus La protein
Similarity search - Component
Biological speciesHomo sapiens (human)
MethodX-RAY DIFFRACTION / SYNCHROTRON / MAD / Resolution: 1.85 Å
AuthorsTeplova, M. / Yuan, Y.R. / Ilin, S. / Malinina, L. / Phan, A.T. / Teplov, A. / Patel, D.J.
CitationJournal: Mol.Cell / Year: 2006
Title: Structural Basis for Recognition and Sequestration of UUU(OH) 3' Temini of Nascent RNA Polymerase III Transcripts by La, a Rheumatic Disease Autoantigen.
Authors: Teplova, M. / Yuan, Y.R. / Phan, A.T. / Malinina, L. / Ilin, S. / Teplov, A. / Patel, D.J.
History
DepositionApr 22, 2005Deposition site: RCSB / Processing site: RCSB
Revision 1.0Jan 17, 2006Provider: repository / Type: Initial release
Revision 1.1Apr 30, 2008Group: Version format compliance
Revision 1.2Jul 13, 2011Group: Advisory / Version format compliance
Revision 1.3Oct 16, 2024Group: Data collection / Database references ...Data collection / Database references / Derived calculations / Structure summary
Category: chem_comp_atom / chem_comp_bond ...chem_comp_atom / chem_comp_bond / database_2 / pdbx_entry_details / pdbx_modification_feature / struct_conn / struct_ref_seq_dif / struct_site
Item: _database_2.pdbx_DOI / _database_2.pdbx_database_accession ..._database_2.pdbx_DOI / _database_2.pdbx_database_accession / _struct_conn.pdbx_leaving_atom_flag / _struct_ref_seq_dif.details / _struct_site.pdbx_auth_asym_id / _struct_site.pdbx_auth_comp_id / _struct_site.pdbx_auth_seq_id

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Structure visualization

Structure viewerMolecule:
MolmilJmol/JSmol

Downloads & links

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Assembly

Deposited unit
C: 5'-R(*UP*GP*CP*UP*GP*UP*UP*UP*U)-3'
D: 5'-R(*UP*GP*CP*UP*GP*UP*UP*UP*U)-3'
A: Lupus La protein
B: Lupus La protein
hetero molecules


Theoretical massNumber of molelcules
Total (without water)51,9417
Polymers51,6534
Non-polymers2883
Water8,197455
1
D: 5'-R(*UP*GP*CP*UP*GP*UP*UP*UP*U)-3'
A: Lupus La protein
hetero molecules


Theoretical massNumber of molelcules
Total (without water)26,0184
Polymers25,8262
Non-polymers1922
Water362
TypeNameSymmetry operationNumber
identity operation1_555x,y,z1
2
C: 5'-R(*UP*GP*CP*UP*GP*UP*UP*UP*U)-3'
B: Lupus La protein
hetero molecules


Theoretical massNumber of molelcules
Total (without water)25,9223
Polymers25,8262
Non-polymers961
Water362
TypeNameSymmetry operationNumber
identity operation1_555x,y,z1
Unit cell
Length a, b, c (Å)156.209, 55.030, 57.782
Angle α, β, γ (deg.)90.00, 90.00, 90.00
Int Tables number18
Space group name H-MP21212

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Components

#1: RNA chain 5'-R(*UP*GP*CP*UP*GP*UP*UP*UP*U)-3'


Mass: 2787.631 Da / Num. of mol.: 2 / Source method: obtained synthetically
#2: Protein Lupus La protein / Sjogren syndrome type B antigen / SS-B / La ribonucleoprotein / La autoantigen


Mass: 23038.621 Da / Num. of mol.: 2 / Fragment: N-terminal domain (residues 1-194)
Source method: isolated from a genetically manipulated source
Source: (gene. exp.) Homo sapiens (human) / Gene: SSB / Production host: Escherichia coli (E. coli) / References: UniProt: P05455
#3: Chemical ChemComp-SO4 / SULFATE ION


Mass: 96.063 Da / Num. of mol.: 3 / Source method: obtained synthetically / Formula: SO4
#4: Water ChemComp-HOH / water


Mass: 18.015 Da / Num. of mol.: 455 / Source method: isolated from a natural source / Formula: H2O
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: 2.4 Å3/Da / Density % sol: 40 %
Crystal growTemperature: 277 K / Method: vapor diffusion, hanging drop / pH: 4.6
Details: PEG 8000, lithium sulfate, potassium chloride, sodium acetate, pH 4.6, VAPOR DIFFUSION, HANGING DROP, temperature 277K
Components of the solutions
IDNameCrystal-IDSol-ID
1PEG 800011
2lithium sulfate11
3potassium chloride11
4sodium acetate11
5H2011
6PEG 800012
7lithium sulfate12
8potassium chloride12
9sodium acetate12
10H2012

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Data collection

Diffraction
IDMean temperature (K)Crystal-ID
11001
21
1,21
Diffraction source
SourceSiteBeamlineIDWavelength (Å)
SYNCHROTRONNSLS X2511.1
SYNCHROTRONNSLS X2520.9798, 0.9795, 0.9611
Detector
TypeIDDetectorDateDetails
ADSC QUANTUM 3151CCDFeb 16, 2005mirrors
ADSC QUANTUM 3152CCDJan 26, 2005mirrors
Radiation
IDProtocolMonochromatic (M) / Laue (L)Scattering typeWavelength-ID
1SINGLE WAVELENGTHMx-ray1
2MADMx-ray2
Radiation wavelength
IDWavelength (Å)Relative weight
11.11
20.97981
30.97951
40.96111
ReflectionResolution: 1.85→20 Å / Num. obs: 42919 / % possible obs: 99.4 % / Observed criterion σ(F): 2 / Observed criterion σ(I): 2 / Redundancy: 5.3 % / Rsym value: 0.103 / Net I/σ(I): 14.9
Reflection shellResolution: 1.85→1.92 Å / Redundancy: 5.3 % / Rmerge(I) obs: 0.496 / Mean I/σ(I) obs: 3.7 / Num. unique all: 4221 / % possible all: 99.4

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Processing

Software
NameVersionClassification
REFMAC5.2.0005refinement
CBASSdata collection
HKL-2000data scaling
SHARPphasing
RefinementMethod to determine structure: MAD / Resolution: 1.85→19.92 Å / Cor.coef. Fo:Fc: 0.939 / Cor.coef. Fo:Fc free: 0.904 / SU B: 5.914 / SU ML: 0.096 / TLS residual ADP flag: LIKELY RESIDUAL / Cross valid method: THROUGHOUT / σ(F): 2 / ESU R: 0.148 / ESU R Free: 0.143 / Stereochemistry target values: MAXIMUM LIKELIHOOD / Details: HYDROGENS HAVE BEEN ADDED IN THE RIDING POSITIONS
RfactorNum. reflection% reflectionSelection details
Rfree0.24528 2192 5.1 %RANDOM
Rwork0.20022 ---
obs0.20252 40918 99.37 %-
Solvent computationIon probe radii: 0.8 Å / Shrinkage radii: 0.8 Å / VDW probe radii: 1.2 Å / Solvent model: BABINET MODEL WITH MASK
Displacement parametersBiso mean: 25.172 Å2
Baniso -1Baniso -2Baniso -3
1--0.18 Å20 Å20 Å2
2--0.09 Å20 Å2
3---0.08 Å2
Refinement stepCycle: LAST / Resolution: 1.85→19.92 Å
ProteinNucleic acidLigandSolventTotal
Num. atoms3050 366 15 455 3886
Refine LS restraints
Refine-IDTypeDev idealDev ideal targetNumber
X-RAY DIFFRACTIONr_bond_refined_d0.0110.0223530
X-RAY DIFFRACTIONr_bond_other_d
X-RAY DIFFRACTIONr_angle_refined_deg1.6812.1124826
X-RAY DIFFRACTIONr_angle_other_deg
X-RAY DIFFRACTIONr_dihedral_angle_1_deg6.0375367
X-RAY DIFFRACTIONr_dihedral_angle_2_deg37.83125.033153
X-RAY DIFFRACTIONr_dihedral_angle_3_deg13.40415620
X-RAY DIFFRACTIONr_dihedral_angle_4_deg15.7541516
X-RAY DIFFRACTIONr_chiral_restr0.1130.2544
X-RAY DIFFRACTIONr_gen_planes_refined0.0070.022478
X-RAY DIFFRACTIONr_gen_planes_other
X-RAY DIFFRACTIONr_nbd_refined0.2080.21228
X-RAY DIFFRACTIONr_nbd_other
X-RAY DIFFRACTIONr_nbtor_refined0.2980.22329
X-RAY DIFFRACTIONr_nbtor_other
X-RAY DIFFRACTIONr_xyhbond_nbd_refined0.1860.2283
X-RAY DIFFRACTIONr_xyhbond_nbd_other
X-RAY DIFFRACTIONr_metal_ion_refined
X-RAY DIFFRACTIONr_metal_ion_other
X-RAY DIFFRACTIONr_symmetry_vdw_refined0.1760.247
X-RAY DIFFRACTIONr_symmetry_vdw_other
X-RAY DIFFRACTIONr_symmetry_hbond_refined0.1830.217
X-RAY DIFFRACTIONr_symmetry_hbond_other
X-RAY DIFFRACTIONr_symmetry_metal_ion_refined
X-RAY DIFFRACTIONr_symmetry_metal_ion_other
X-RAY DIFFRACTIONr_mcbond_it0.911.51942
X-RAY DIFFRACTIONr_mcbond_other
X-RAY DIFFRACTIONr_mcangle_it1.37723001
X-RAY DIFFRACTIONr_scbond_it2.16731916
X-RAY DIFFRACTIONr_scangle_it3.2664.51825
X-RAY DIFFRACTIONr_rigid_bond_restr
X-RAY DIFFRACTIONr_sphericity_free
X-RAY DIFFRACTIONr_sphericity_bonded
LS refinement shellResolution: 1.85→1.898 Å / Total num. of bins used: 20
RfactorNum. reflection% reflection
Rfree0.267 166 -
Rwork0.224 2943 -
obs--99.36 %
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)
11.4356-0.3842-0.64452.077-0.25592.4255-0.0733-0.0099-0.11970.08960.0165-0.00370.08010.01140.0568-0.0652-0.0028-0.0047-0.0551-0.0014-0.037958.6822-21.9858-41.7795
22.2560.2054-0.94111.5820.12682.04630.1042-0.07050.1462-0.04380.0541-0.182-0.26960.1427-0.1583-0.0487-0.00990.002-0.07-0.0116-0.027260.68243.0083-39.5119
30.6115-0.08060.44611.83110.17462.6953-0.0872-0.04650.05850.06170.02460.0416-0.1607-0.04380.0626-0.045-0.00220.0052-0.0478-0.0035-0.046922.58217.4302-45.1746
42.38540.05021.65881.3763-0.59583.63580.150.0008-0.2106-0.10710.09610.16190.3847-0.1393-0.2461-0.0434-0.0053-0.0125-0.08180.0047-0.007120.188-7.4518-44.0297
51.4286-0.2563-0.01480.23190.00740.0003-0.00990.29750.0272-0.0375-0.0310.0169-0.02920.02060.0409-0.00490.0182-0.00920.0824-0.0071-0.022640.9898-2.1759-48.1384
Refinement TLS group
IDRefine-IDRefine TLS-IDAuth asym-IDLabel asym-IDAuth seq-IDLabel seq-ID
1X-RAY DIFFRACTION1AC6 - 997 - 100
2X-RAY DIFFRACTION2AC100 - 189101 - 190
3X-RAY DIFFRACTION3BD7 - 998 - 100
4X-RAY DIFFRACTION4BD100 - 189101 - 190
5X-RAY DIFFRACTION5CA1 - 91 - 9
6X-RAY DIFFRACTION5DB1 - 91 - 9

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