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CRYSTAL STRUCTURE OF HIV-1 REVERSE TRANSCRIPTASE (RT) IN COMPLEX WITH JANSSEN-R185545
1SUQ
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  •   Molecular Description Hide
    Classification: Transferase
    Structure Weight: 115258.60
    Molecule: REVERSE TRANSCRIPTASE
    Polymer: 1 Type: protein Length: 560
    Chains: A
    EC#: 2.7.7.49    2.7.7.7    3.1.26.13   
    Fragment: P66 SUBUNIT
    Mutation: L31V, C280S
    Organism: Human immunodeficiency virus 1
    Gene Name: gag-pol
    UniProtKB: Protein Feature View | Search PDB | P03366  
    Molecule: REVERSE TRANSCRIPTASE
    Polymer: 2 Type: protein Length: 430
    Chains: B
    EC#: 2.7.7.49    2.7.7.7    3.1.26.13   
    Fragment: P51 SUBUNIT
    Mutation: C280S
    Organism: Human immunodeficiency virus 1
    Gene Name: gag-pol
    UniProtKB: Protein Feature View | Search PDB | P03366  
     
  •   Structure Validation Hide

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  •   Related Citations in PDB Entry (REMARK 1) Hide
     
  •   Source Hide
    Polymer: 1
    Scientific Name: Human immunodeficiency virus 1   Taxonomy   Expression System: Escherichia coli  
    Polymer: 2
    Scientific Name: Human immunodeficiency virus 1   Taxonomy   Expression System: Escherichia coli  
     
  •   Related PDB Entries Hide
    Identifier Details
    1HNI  THE STRUCTURE OF HIV-1 REVERSE TRANSCRIPTASE IN A COMPLEX WITH THE NON-NUCLEOSIDE INHIBITOR ALPHA-APA R 95845 
    1HNV  THE STRUCTURE OF HIV-1 RT/TIBO R 86183 COMPLEX 
    1S6P  THE CRYSTAL STRUCTURE OF HUMAN IMMUNODEFICIENCY VIRUS TYPE 1 REVERSE TRANSCRIPTASE (RT) IN COMPLEX WITH JANSSEN-R100943 
    1S6Q  THE CRYSTAL STRUCTURE OF HIV-1 REVERSE TRANSCRIPTASE (RT) IN COMPLEX WITH JANSSEN-R147681 
    1S9E  THE CRYSTAL STRUCTURE OF HIV-1 REVERSE TRANSCRIPTASE (RT) IN COMPLEX WITH JANSSEN-R129385 
    1S9G  THE CRYSTAL STRUCTURE OF HIV-1 REVERSE TRANSCRIPTASE (RT) IN COMPLEX WITH JANSSEN-R120394 
    1SV5  THE CRYSTAL STRUCTURE OF HIV-1 REVERSE TRANSCRIPTASE (RT) IN COMPLEX WITH JANSSEN-R165335 
    2HMI  HIV-1 REVERSE TRANSCRIPTASE COMPLEXED WITH A DOUBLE -STRANDED DNA AND FAB28 
     
  •   Ligand Chemical Component Hide
    Identifier Formula Name View Interactions
    185
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    185 C21 H16 Br N5 O2
    (6-[4-(AMINOMETHYL)-2,6-DIMETHYLPHENOXY]- 2-{[4-(AMINOMETHYL)PHENYL]AMINO}-5-BROMOPYRIMIDIN- 4-YL)METHANOL
    185:1SUQ
    MG
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    MG Mg
    MAGNESIUM ION
     
  •   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 and generated by PISA (software)
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  •   Deposition Summary Hide
    Authors:   Das, K.,  Arnold, E.

    Deposition:   2004-03-26
    Release:   2004-05-11
    Last Modified (REVDAT):   2009-02-24
     
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    2011-07-13
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  •   Experimental Details Hide
    Method:   X-RAY DIFFRACTION
    Exp. Data:
      Structure Factors
    EDS  
    Resolution[Å]:   3.00
    R-Value: 0.262 (obs.)
    R-Free: 0.325
    Space Group: C 2
    Unit Cell:
      Length [Å] Angles [°]
    a = 226.11 α = 90.00 
    b = 69.47 β = 106.82 
    c = 104.26 γ = 90.00