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- PDB-1ehz: The crystal structure of yeast phenylalanine tRNA at 1.93 A resolution -

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Basic information

Entry
Database: PDB / ID: 1ehz
TitleThe crystal structure of yeast phenylalanine tRNA at 1.93 A resolution
ComponentsTRANSFER RNA (PHE)
KeywordsRNA / tRNA / yeast / phenylalanine
Function / homology: / : / RNA / RNA (> 10)
Function and homology information
Biological speciesSaccharomyces cerevisiae (brewer's yeast)
MethodX-RAY DIFFRACTION / SYNCHROTRON / Resolution: 1.93 Å
AuthorsShi, H. / Moore, P.B.
CitationJournal: RNA / Year: 2000
Title: The crystal structure of yeast phenylalanine tRNA at 1.93 A resolution: a classic structure revisited
Authors: Shi, H. / Moore, P.B.
History
DepositionFeb 23, 2000Deposition site: NDB / Processing site: NDB
Revision 1.0Oct 2, 2000Provider: repository / Type: Initial release
Revision 1.1Apr 27, 2008Group: Version format compliance
Revision 1.2Jul 13, 2011Group: Non-polymer description / Version format compliance
Revision 1.3Dec 21, 2011Group: Source and taxonomy
Revision 1.4Dec 21, 2022Group: Database references / Derived calculations
Category: database_2 / pdbx_struct_conn_angle ...database_2 / pdbx_struct_conn_angle / 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 / _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.ptnr2_auth_comp_id / _pdbx_struct_conn_angle.ptnr2_auth_seq_id / _pdbx_struct_conn_angle.ptnr2_label_asym_id / _pdbx_struct_conn_angle.ptnr2_label_atom_id / _pdbx_struct_conn_angle.ptnr2_label_comp_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.pdbx_dist_value / _struct_conn.pdbx_leaving_atom_flag / _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_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 / _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
A: TRANSFER RNA (PHE)
hetero molecules


Theoretical massNumber of molelcules
Total (without water)25,20110
Polymers24,8901
Non-polymers3119
Water2,882160
1


  • Idetical with deposited unit
  • defined by author
TypeNameSymmetry operationNumber
identity operation1_555x,y,z1
Unit cell
Length a, b, c (Å)54.981, 33.389, 61.921
Angle α, β, γ (deg.)90.00, 90.20, 90.00
Int Tables number4
Cell settingmonoclinic
Space group name H-MP1211
DetailsThe biological assembly is a monomer.

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Components

#1: RNA chain TRANSFER RNA (PHE)


Mass: 24890.121 Da / Num. of mol.: 1 / Source method: isolated from a natural source
Details: abundant form, purified from the natural mixture by electrophoresis
Source: (natural) Saccharomyces cerevisiae (brewer's yeast) / References: GenBank: M10263
#2: Chemical
ChemComp-MG / MAGNESIUM ION


Mass: 24.305 Da / Num. of mol.: 6 / Source method: obtained synthetically / Formula: Mg
#3: Chemical ChemComp-MN / MANGANESE (II) ION


Mass: 54.938 Da / Num. of mol.: 3 / Source method: obtained synthetically / Formula: Mn
#4: Water ChemComp-HOH / water / Water


Mass: 18.015 Da / Num. of mol.: 160 / Source method: isolated from a natural source / Formula: H2O

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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: 2.28 Å3/Da / Density % sol: 46.13 %
Crystal growTemperature: 277 K / Method: vapor diffusion, hanging drop / pH: 6.5
Details: isopropanol, MgCl2, spermine, cacodylate, pH 6 to 7, pH 6.5, VAPOR DIFFUSION, HANGING DROP, temperature 277K
Components of the solutions
IDNameCrystal-IDSol-ID
1MgCl211
2spermine11
3cacodylateCacodylic acid11
4isopropanol11
5isopropanol12
Crystal grow
*PLUS
PH range low: 7 / PH range high: 6
Components of the solutions
*PLUS
IDConc.Common nameCrystal-IDSol-IDChemical formula
14 mg/mlprotein1drop
27-9 %isopropanol1reservoir
340 mM1reservoirMgCl2
43 mMspermine1reservoir
540 mMsodium cacodylate1reservoir

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Data collection

DiffractionMean temperature: 80 K
Diffraction sourceSource: SYNCHROTRON / Site: CHESS / Beamline: A1 / Wavelength: 0.913
DetectorDetector: CCD
RadiationProtocol: SINGLE WAVELENGTH / Monochromatic (M) / Laue (L): M / Scattering type: x-ray
Radiation wavelengthWavelength: 0.913 Å / Relative weight: 1
ReflectionResolution: 1.8→40 Å / Num. all: 20604 / Num. obs: 19877 / % possible obs: 96.5 % / Redundancy: 14 % / Biso Wilson estimate: 47.9 Å2 / Rmerge(I) obs: 0.057 / Net I/σ(I): 22.4
Reflection shell
*PLUS
% possible obs: 83.3 % / Rmerge(I) obs: 0.285 / Mean I/σ(I) obs: 3.6

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Processing

Software
NameClassification
DENZOdata reduction
SCALEPACKdata scaling
CNSrefinement
CNSphasing
RefinementResolution: 1.93→40 Å / Cross valid method: THROUGHOUT / σ(F): 0 / Stereochemistry target values: Parkinson et al.
RfactorNum. reflection% reflectionSelection details
Rfree0.253 1525 10 %RANDOM
Rwork0.2334 ---
all-15371 --
obs-15371 88.9 %-
Displacement parameters
Baniso -1Baniso -2Baniso -3
1--0.186 Å20 Å2-1.147 Å2
2---2.157 Å20 Å2
3---2.343 Å2
Refinement stepCycle: LAST / Resolution: 1.93→40 Å
ProteinNucleic acidLigandSolventTotal
Num. atoms0 1652 9 160 1821
Refine LS restraints
Refine-IDTypeDev ideal
X-RAY DIFFRACTIONc_bond_d0.0124
X-RAY DIFFRACTIONc_angle_deg1.605
Software
*PLUS
Name: CNS / Classification: refinement
Refinement
*PLUS
Lowest resolution: 40 Å / σ(F): 0 / % reflection Rfree: 10 % / Rfactor obs: 0.2334 / Rfactor Rfree: 0.253
Solvent computation
*PLUS
Displacement parameters
*PLUS

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