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- PDB-2kx2: The solution structure of MTH1821 -

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Basic information

Entry
Database: PDB / ID: 2kx2
TitleThe solution structure of MTH1821
ComponentsPutative uncharacterized protein
KeywordsSTRUCTURAL GENOMICS / UNKNOWN FUNCTION / methanobacterium thermoautotrophicum / Structural Genomics Consortium / SGC
Function / homologyTranslation Initiation Factor Eif1 - #30 / Family of unknown function (DUF5750) / Translation Initiation Factor Eif1 / 2-Layer Sandwich / Alpha Beta / Uncharacterized protein
Function and homology information
Biological speciesMethanobacterium thermoautotrophicum (archaea)
MethodSOLUTION NMR / torsion angle dynamics
Model detailslowest energy, model 1
AuthorsLee, W. / Ko, S. / Structural Genomics Consortium (SGC)
CitationJournal: Proteins / Year: 2011
Title: Solution structure of MTH1821, a putative structure homologue to RNA polymerase alpha subunit from Methanobacterium thermoautotrophicum.
Authors: Ko, S. / Kim, H. / Yun, J. / Yee, A. / Arrowsmith, C.H. / Cheong, C. / Lee, W.
History
DepositionApr 23, 2010Deposition site: BMRB / Processing site: PDBJ
Revision 1.0Apr 27, 2011Provider: repository / Type: Initial release
Revision 1.1Jul 13, 2011Group: Version format compliance
Revision 1.2Feb 26, 2020Group: Data collection / Database references / Other
Category: database_2 / pdbx_database_status / pdbx_nmr_software
Item: _pdbx_database_status.status_code_cs / _pdbx_nmr_software.name
Revision 1.3Jun 14, 2023Group: Database references / Other / Category: database_2 / pdbx_database_status
Item: _database_2.pdbx_DOI / _database_2.pdbx_database_accession / _pdbx_database_status.status_code_nmr_data
Revision 1.4May 15, 2024Group: Data collection / Database references / Category: chem_comp_atom / chem_comp_bond / database_2 / Item: _database_2.pdbx_DOI

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Structure visualization

Structure viewerMolecule:
MolmilJmol/JSmol

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Assembly

Deposited unit
A: Putative uncharacterized protein


Theoretical massNumber of molelcules
Total (without water)11,4841
Polymers11,4841
Non-polymers00
Water0
1


  • Idetical with deposited unit
  • defined by author
TypeNameSymmetry operationNumber
identity operation1_555x,y,z1
NMR ensembles
DataCriteria
Number of conformers (submitted / calculated)20 / 100target function
RepresentativeModel #1lowest energy

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Components

#1: Protein Putative uncharacterized protein / MTH1821


Mass: 11483.926 Da / Num. of mol.: 1
Source method: isolated from a genetically manipulated source
Source: (gene. exp.) Methanobacterium thermoautotrophicum (archaea)
Gene: MTH1821, MTH_1821 / Production host: Escherichia coli (E. coli) / References: UniProt: O27849

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Experimental details

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Experiment

ExperimentMethod: SOLUTION NMR
NMR experiment
Conditions-IDExperiment-IDSolution-IDType
1112D 1H-15N HSQC
1233D CBCA(CO)NH
1333D HNCO
1433D HNCA
1533D HN(CA)CB
1633D HBHA(CO)NH
1733D H(CCO)NH
1823D (H)CCH-COSY
1913D 1H-15N NOESY
11023D 1H-13C NOESY

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Sample preparation

Details
Solution-IDContentsSolvent system
11.2 mM [U-99% 15N] MTH1821-1, 90% H2O/10% D2O90% H2O/10% D2O
21.2 mM [U-100% 13C] MTH1821-2, 100% D2O100% D2O
31.2 mM [U-99% 13C; U-99% 15N] MTH1821-3, 90% H2O/10% D2O90% H2O/10% D2O
Sample
Conc. (mg/ml)ComponentIsotopic labelingSolution-ID
1.2 mMMTH1821-1[U-99% 15N]1
1.2 mMMTH1821-2[U-100% 13C]2
1.2 mMMTH1821-3[U-99% 13C; U-99% 15N]3
Sample conditionsIonic strength: 100 / pH: 6.5 / Pressure: AMBIENT / Temperature: 298 K

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NMR measurement

NMR spectrometer
TypeManufacturerModelField strength (MHz)Spectrometer-ID
Bruker DRXBrukerDRX5001
Bruker DRXBrukerDRX9002

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Processing

NMR software
NameVersionDeveloperClassification
CYANA2.2.5Guntert, Mumenthaler and Wuthrichrefinement
CYANA2.2.5Guntert, Mumenthaler and Wuthrichstructure solution
CYANA2.2.5Guntert, Mumenthaler and Wuthrichchemical shift assignment
XwinNMRBruker Biospincollection
AutoAssignZimmerman, Moseley, Kulikowski and Montelionechemical shift assignment
NMRDrawDelaglio, Grzesiek, Vuister, Zhu, Pfeifer and Baxdata analysis
NMRPipeDelaglio, Grzesiek, Vuister, Zhu, Pfeifer and Baxprocessing
SparkyGoddardpeak picking
TALOSCornilescu, Delaglio and Baxdata analysis
RefinementMethod: torsion angle dynamics / Software ordinal: 1
NMR representativeSelection criteria: lowest energy
NMR ensembleConformer selection criteria: target function / Conformers calculated total number: 100 / Conformers submitted total number: 20 / Representative conformer: 1

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