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Structure of dimeric antithrombin complexed with a P14-P9 reactive loop peptide and an exogenous tripeptide (formyl-norleucine-LF)
1R1L
Primary Citation
 
 
  •   Molecular Description Hide
    Classification: Hydrolase/hydrolase Inhibitor
    Structure Weight: 100825.66
    Molecule: Antithrombin-III
    Polymer: 1 Type: protein Length: 432
    Chains: I, L
    Organism: Homo sapiens
    Gene Names: Gene View for SERPINC1 AT3 PRO0309
    UniProtKB: Protein Feature View | Search PDB | P01008  
    Molecule: Antithrombin P14-P9 peptide
    Polymer: 2 Type: protein Length: 7
    Chains: C
    Molecule: EXOGENOUS TRIPEPTIDE formyl-(NLE)LF
    Polymer: 3 Type: protein Length: 3
    Chains: D
     
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  •   Source Hide
    Polymer: 1
    Scientific Name: Homo sapiens   Taxonomy   Common Name: Human  
    Polymer: 2
    Scientific Name: Synthetic construct   Taxonomy    
    Polymer: 3
    Scientific Name: Synthetic construct   Taxonomy    
     
  •   Related PDB Entries Hide
    Identifier Details
    1JVQ  Structure of dimeric antithrombin complexed with a P14-P8 reactive loop peptide and an exogenous tetrapeptide 
    1LK6  2.8A structure of dimeric antithrombin complexed with a P14-P9 reactive loop peptide and an exogenous tripeptide (formyl-MLF) 
     
  •   Ligand Chemical Component Hide
    Identifier Formula Name View Interactions
    FOR
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    FOR C H2 O
    FORMYL GROUP
    GOL
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    GOL C3 H8 O3
    GLYCEROL
    NAG
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    NAG C8 H15 N O6
    N-ACETYL-D-GLUCOSAMINE
    NAG:1R1L
     
  •   Modified Residues Hide
    Identifier Formula Parent Type
    ACE
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    ACE C2 H4 O nonPolymer
    NLE
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    NLE C6 H13 N O2 LEU lPeptideLinking
     
  •   External Domain Annotations Hide
     
  •   Structural Biology Knowledgebase Data Hide
     
 
Data in orange boxes are gathered from external resources (when available).
 
  Biological Assembly       
Biological assembly 1 assigned by authors
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  •   Deposition Summary Hide
    Authors:   Zhou, A.,  Huntington, J.A.,  Lomas, D.A.,  Stein, P.E.,  Carrell, R.W.

    Deposition:   2003-09-24
    Release:   2004-10-05
    Last Modified (REVDAT):   2011-07-13
     
  •   Revision History    Hide
    Mouse over text for details
    2011-07-13
    Binding sites and description
    2011-07-13
    Non-polymer description
    2011-07-13
    Function and keywords
    2011-07-13
    Linkage
    2011-07-13
    Sequence database correspondence
    2011-07-13
    Polymer description
    2011-07-13
    Version format compliance
    2011-07-13
    Atom nomenclature
     
  •   Experimental Details Hide
    Method:   X-RAY DIFFRACTION
    Exp. Data:
      Structure Factors
    EDS  
    Resolution[Å]:   2.70
    R-Value: 0.204 (work)
    R-Free: 0.249
    Space Group: P 21
    Unit Cell:
      Length [Å] Angles [°]
    a = 69.17 α = 90.00 
    b = 100.42 β = 104.29 
    c = 87.20 γ = 90.00