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Yorodumi- PDB-1nem: Saccharide-RNA recognition in the neomycin B / RNA aptamer complex -
+Open data
-Basic information
Entry | Database: PDB / ID: 1nem | |||||||||||||||||||||
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Title | Saccharide-RNA recognition in the neomycin B / RNA aptamer complex | |||||||||||||||||||||
Components | 5'-R(*Keywords | RNA / RNA APTAMER / AMINOGLYCOSIDE / ANTIBIOTIC | Function / homology | 2,6-diamino-2,6-dideoxy-alpha-D-glucopyranose / 2-DEOXY-D-STREPTAMINE / RNA / RNA (> 10) | Function and homology information Method | SOLUTION NMR / DISTANCE RESTRAINED MOLECULAR DYNAMICS | Authors | Jiang, L. / Majumdar, A. / Hu, W. / Jaishree, T.J. / Xu, W. / Patel, D.J. | Citation | Journal: Structure Fold.Des. / Year: 1999 | Title: Saccharide-RNA recognition in a complex formed between neomycin B and an RNA aptamer Authors: Jiang, L. / Majumdar, A. / Hu, W. / Jaishree, T.J. / Xu, W. / Patel, D.J. History |
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-Structure visualization
Structure viewer | Molecule: MolmilJmol/JSmol |
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-Downloads & links
-Download
PDBx/mmCIF format | 1nem.cif.gz | 165.7 KB | Display | PDBx/mmCIF format |
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PDB format | pdb1nem.ent.gz | 134.8 KB | Display | PDB format |
PDBx/mmJSON format | 1nem.json.gz | Tree view | PDBx/mmJSON format | |
Others | Other downloads |
-Validation report
Summary document | 1nem_validation.pdf.gz | 451.9 KB | Display | wwPDB validaton report |
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Full document | 1nem_full_validation.pdf.gz | 533.4 KB | Display | |
Data in XML | 1nem_validation.xml.gz | 9.1 KB | Display | |
Data in CIF | 1nem_validation.cif.gz | 13.5 KB | Display | |
Arichive directory | https://data.pdbj.org/pub/pdb/validation_reports/ne/1nem ftp://data.pdbj.org/pub/pdb/validation_reports/ne/1nem | HTTPS FTP |
-Related structure data
Similar structure data |
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-Links
-Assembly
Deposited unit |
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1 |
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NMR ensembles |
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-Components
#1: RNA chain | Mass: 7459.481 Da / Num. of mol.: 1 / Source method: obtained synthetically Details: Complexed with neomycin B; hetero groups BDG (ring A), NEB (ring B), RIB (ring C), and NED (ring D) |
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#2: Polysaccharide | 2,6-diamino-2,6-dideoxy-beta-L-idopyranose-(1-3)-beta-D-ribofuranose Source method: isolated from a genetically manipulated source |
#3: Sugar | ChemComp-BDG / |
#4: Chemical | ChemComp-NEB / |
-Experimental details
-Experiment
Experiment | Method: SOLUTION NMR |
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NMR details | Text: EXPERIMENTS CONDUCTED IN D2O: 2D NOESY (50MS,120MS,200MS,300MS) PHASE-SENSITIVE COSY, TOCSY, (1H)- (13)C HSQC 3D (1H)-(13)C NOESY-HMQC (120MS, 300MS) 3D HCCH- COSY 3D HCCH-TOCSY 2D (1H)-(13)C ...Text: EXPERIMENTS CONDUCTED IN D2O: 2D NOESY (50MS,120MS,200MS,300MS) PHASE-SENSITIVE COSY, TOCSY, (1H)- (13)C HSQC 3D (1H)-(13)C NOESY-HMQC (120MS, 300MS) 3D HCCH- COSY 3D HCCH-TOCSY 2D (1H)-(13)C HCCH-TOCSY (65MS) 2D (1H)-(31)P CORRELATION 3D (1H)-(13)C-(31)P CORRELATION |
-Sample preparation
Sample conditions | Ionic strength: 10mM NA3PO4 / pH: 6.1 / Pressure: 1 atm / Temperature: 298 K |
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Crystal grow | *PLUS Method: other / Details: NMR |
-Processing
NMR software | Name: X-PLOR / Version: 3.1 / Developer: BRUNGER / Classification: refinement |
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Refinement | Method: DISTANCE RESTRAINED MOLECULAR DYNAMICS / Software ordinal: 1 |
NMR ensemble | Conformer selection criteria: LEAST RESTRAINT VIOLATION / Conformers calculated total number: 100 / Conformers submitted total number: 9 |