3HF4

Crystal structure of rat methemoglobin in R2 state


Experimental Data Snapshot

  • Method: X-RAY DIFFRACTION
  • Resolution: 2.70 Å
  • R-Value Free: 0.275 
  • R-Value Work: 0.213 
  • R-Value Observed: 0.219 

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Ligand Structure Quality Assessment 


This is version 1.6 of the entry. See complete history


Literature

Quaternary structural variability in rat hemoglobin

Neelagandan, K.Sathya Moorthy, P.Balasubramanian, M.Ponnuswamy, M.N.

To be published.

Macromolecules
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Entity ID: 1
MoleculeChains Sequence LengthOrganismDetailsImage
Hemoglobin subunit alpha-1/2A,
C [auth E]
141Rattus norvegicusMutation(s): 0 
UniProt
Find proteins for P01946 (Rattus norvegicus)
Explore P01946 
Go to UniProtKB:  P01946
Entity Groups  
Sequence Clusters30% Identity50% Identity70% Identity90% Identity95% Identity100% Identity
UniProt GroupP01946
Sequence Annotations
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  • Reference Sequence
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Entity ID: 2
MoleculeChains Sequence LengthOrganismDetailsImage
Hemoglobin subunit beta-1B,
D [auth F]
146Rattus norvegicusMutation(s): 0 
UniProt
Find proteins for P02091 (Rattus norvegicus)
Explore P02091 
Go to UniProtKB:  P02091
Entity Groups  
Sequence Clusters30% Identity50% Identity70% Identity90% Identity95% Identity100% Identity
UniProt GroupP02091
Sequence Annotations
Expand
  • Reference Sequence
Experimental Data & Validation

Experimental Data

  • Method: X-RAY DIFFRACTION
  • Resolution: 2.70 Å
  • R-Value Free: 0.275 
  • R-Value Work: 0.213 
  • R-Value Observed: 0.219 
  • Space Group: C 1 2 1
Unit Cell:
Length ( Å )Angle ( ˚ )
a = 94.14α = 90
b = 54.015β = 93.8
c = 115.008γ = 90
Software Package:
Software NamePurpose
MAR345data collection
MOLREPphasing
REFMACrefinement
AUTOMARdata reduction

Structure Validation

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Ligand Structure Quality Assessment 


Entry History 

Deposition Data

Revision History  (Full details and data files)

  • Version 1.0: 2010-05-19
    Type: Initial release
  • Version 1.1: 2011-07-13
    Changes: Version format compliance
  • Version 1.2: 2017-11-01
    Changes: Refinement description
  • Version 1.3: 2018-01-31
    Changes: Experimental preparation
  • Version 1.4: 2018-06-20
    Changes: Data collection, Database references, Structure summary
  • Version 1.5: 2020-01-15
    Changes: Advisory, Derived calculations
  • Version 1.6: 2023-11-01
    Changes: Data collection, Database references, Derived calculations, Refinement description