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Crystal structure of V106A mutant HIV-1 reverse transcriptase in complex with UC-781
 
 
DOI:10.2210/pdb1s1w/pdb
1S1W
 
Primary Citation
spinning wheel
 
 
  •  
    Move Section Molecular Description Hide
    Classification: Transferase
    Structure Weight: 116275.05
     
    Molecule:Reverse transcriptase
    Polymer:1Type:polypeptide(L)Length:560
    Chains:A
    EC#:2.7.7.49 Go to IUBMB EC entry  
    Fragment:P66
    Mutation:V106A
    Molecule:Reverse transcriptase
    Polymer:2Type:polypeptide(L)Length:440
    Chains:B
    EC#:2.7.7.49 Go to IUBMB EC entry  
    Fragment:P51
    Mutation:V106A
     
     
  •  
    Move Section Source Hide
    Polymer: 1
    Scientific Name: Human immunodeficiency virus 1 Go to NCBI Taxonomy entry Expression System: Escherichia coli  
    Polymer: 2
    Scientific Name: Human immunodeficiency virus 1 Go to NCBI Taxonomy entry Expression System: Escherichia coli  
     
     
  •  
    Move Section Related PDB Entries Hide
    Id Details
    1C0T  HIV-1 RT COMPLEXED WITH BM+21.1326 
    1C0U  HIV-1 RT COMPLEXED WITH BM+50.0934 
    1C1B  HIV-1 RT COMPLEXED WITH GCA-186 
    1C1C  HIV-1 RT COMPLEXED WITH TNK-6123 
    1DTQ  HIV-1 RT COMPLEXED WITH PETT-1 
    1DTT  HIV-1 RT COMPLEXED WITH PETT-2 
    1EP4  HIV-1 RT COMPLEXED WITH S-1153 
    1FK9  HIV-1 RT COMPLEXED WITH DMP-226 (EFAVIRENZ) 
    1FKO  K103N MUTANT HIV-1 RT COMPLEXED WITH DMP-226 (EFAVIRENZ) 
    1FKP  K103N MUTANT HIV-1 RT COMPLEXED WITH NEVIRAPINE 
    1JKH  Y181C MUTANT HIV-1 RT COMPLEXED WITH DMP-226 (EFAVIRENZ) 
    1JLA  Y181C MUTANT HIV-1 RT COMPLEXED TNK-651 
    1JLB  Y181C MUTANT HIV-1 RT COMPLEXED WITH NEVIRAPINE 
    1JLC  Y181C MUTANT HIV-1 RT COMPLEXED WITH PETT-2 
    1JLE  Y188C MUTANT HIV-1 RT 
    1JLF  Y188C MUTANT HIV-1 RT COMPLEXED WITH NEVIRAPINE 
    1JLG  Y188C MUTANT HIV-1 RT COMPLEXED WITH UC-781 
    1JLQ  HIV-1 RT COMPLEXED WITH 739W94 
    1KLM  HIV-1 RT COMPLEXED WITH BHAP (U-90152) 
    1LW0  T215Y MUTANT HIV-1 RT COMPLEXED WITH NEVIRAPINE 
    1LW2  T215Y MUTANT HIV-1 RT COMPLEXED WITH 1051U91 
    1LWC  M184V MUTANT HIV-1 RT COMPLEXED WITH NEVIRAPINE 
    1LWE  RTMN (M41L+T215Y MUTANT HIV-1 RT) COMPLEXED WITH NEVIRAPINE 
    1LWF  RTMQ/M184V (M41L+D67N+K70R+M184V+T215Y MUTANT HIV-1 RT) COMPLEXED WITH NEVIRAPINE 
    1REV  HIV-1 RT COMPLEXED WITH 9-CL-TIBO 
    1RT1  HIV-1 RT COMPLEXED WITH MKC-442 
    1RT2  HIV-1 RT COMPLEXED WITH TNK-651 
    1RT3  AZT DRUG RESISTANT HIV-1 RT MUTANT (RTMC) COMPLEXED WITH 1051U91 
    1RT4  HIV-1 RT COMPLEXED WITH UC-781 
    1RT5  HIV-1 RT COMPLEXED WITH UC-10 
    1RT6  HIV-1 RT COMPLEXED WITH UC-38 
    1RT7  HIV-1 RT COMPLEXED WITH UC-84 
    1RTH  HIV-1 RT COMPLEXED WITH 1051U91 
    1RTI  HIV-1 RT COMPLEXED WITH HEPT 
    1RTJ  HIV-1 RT 
    1S1T  L100I MUTANT HIV-1 RT COMPLEXED WITH UC-781 
    1S1U  L100I MUTANT HIV-1 RT COMPLEXED WITH NEVIRAPINE 
    1S1V  L100I MUTANT HIV-1 RT COMPLEXED WITH TNK-651 
    1S1X  V108I MUTANT HIV-1 RT COMPLEXED WITH NEVIRAPINE 
    1VRT  HIV-1 RT COMPLEXED WITH NEVIRAPINE 
    1VRU  HIV-1 RT COMPLEXED WITH ALPHA-APA 
     
     
  •  
    Move Section Ligand Chemical Component Hide
    Identifier Name Formula Interaction View Links
    UC1     2-METHYL-FURAN-3-CARBOTHIOIC ACID [4-CHLORO- 3-(3-METHYL-BUT-2-ENYLOXY)-PHENYL]
    -AMIDE     		C17 H18 Cl N O2 S 3DLigand Explorer Link out to Ligand Expos:UC1 Link out to SuperLigands:UC1 Link out to SuperHapten:UC1
     
     
  •  
    Move Section Modified Residues Hide
    Identifier Name Formula Interaction View Links
    CSD 3-SULFINOALANINE (parent: CYS)(type: lPeptideLinking) C3 H7 N O4 S 3D Ligand Explorer Link out to Ligand Expos:CSD Link out to SuperLigands:CSD Link out to SuperHapten:CSD 2D
     
     
  •  
    Move Section Derived Data Hide
     
     
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Biological assembly assigned by authors and generated by PISA (software)
 
 
 
  •  
    Move Section Deposition Summary Hide
    Authors:   Ren, J.,   Nichols, C.E.,   Chamberlain, P.P.,   Stammers, D.K.

    Deposition:   2004-01-07
    Release:   2004-06-29
    Last Modified (REVDAT):   2009-02-24
     
     
  •  
    Move Section Experimental Details Hide
    Method:   X-RAY DIFFRACTION
    Experimental Data:   Download Structure Factors  [ EDS External Link to EDS ]
    View a histogram of Resolution Resolution[Å]: 2.70
    R-Value: 0.198 (obs.)
    R-Free: 0.280
    Space Group: P 21 21 21
    Unit Cell:
      Length [Å] Angles [°]
    a = 137.54 α = 90.00 
    b = 114.69 β = 90.00 
    c = 65.26 γ = 90.00