PDB entry 2xaa

View 2xaa on RCSB PDB site
Description: alcohol dehydrogenase adh-'a' from rhodococcus ruber dsm 44541 at ph 8.5 in complex with nad and butane-1,4-diol
Deposited on 2010-03-30, released 2010-08-11
The last revision was dated 2010-09-01, with a file datestamp of 2010-08-27.
Experiment type: XRAY
Resolution: 2.8 Å
R-factor: 0.1916
AEROSPACI score: 0.27 (click here for full SPACI score report)

Chains and heterogens:

  • Chain 'A':
    Compound: secondary alcohol dehydrogenase
    Species: RHODOCOCCUS RUBER [TaxId:1830]
    Database cross-references and differences (RAF-indexed):
    • Uniprot Q8KLT9 (0-344)
      • conflict (3)
      • conflict (17)
      • conflict (21)
      • conflict (79)
      • conflict (110)
      • conflict (237)
      • conflict (261)
      • conflict (302)
  • Chain 'B':
    Compound: secondary alcohol dehydrogenase
    Species: RHODOCOCCUS RUBER [TaxId:1830]
    Database cross-references and differences (RAF-indexed):
    • Uniprot Q8KLT9 (0-344)
      • conflict (3)
      • conflict (17)
      • conflict (21)
      • conflict (79)
      • conflict (110)
      • conflict (237)
      • conflict (261)
      • conflict (302)
  • Chain 'C':
    Compound: secondary alcohol dehydrogenase
    Species: RHODOCOCCUS RUBER [TaxId:1830]
    Database cross-references and differences (RAF-indexed):
    • Uniprot Q8KLT9 (0-344)
      • conflict (3)
      • conflict (17)
      • conflict (21)
      • conflict (72)
      • conflict (79)
      • conflict (110)
      • conflict (261)
      • conflict (302)
  • Chain 'D':
    Compound: secondary alcohol dehydrogenase
    Species: RHODOCOCCUS RUBER [TaxId:1830]
    Database cross-references and differences (RAF-indexed):
    • Uniprot Q8KLT9 (0-344)
      • conflict (3)
      • conflict (17)
      • conflict (21)
      • conflict (72)
      • conflict (79)
      • conflict (110)
      • conflict (237)
      • conflict (261)
      • conflict (302)
  • Heterogens: NAD, ZN, BU1, HOH

PDB Chain Sequences:
This PDB entry is not classified in SCOPe 2.08, so the chain sequences below are not included in the ASTRAL sequence sets.

  • Chain 'A':
    Sequence, based on SEQRES records:
    >2xaaA (A:)
    mkavqyteigsepvvvdiptptpgpgeillkvtaaglchsdifvmdmpaaqyayglpltl
    ghegvgtvaelgegvtgfgvgdavavygpwgcgachacargrenyctraadlgitppglg
    spgsmaeymivdsarhlvpigdldpvaaapltdagltpyhaisrvlpllgpgstavvigv
    gglghvgiqilravsaarviavdldddrlalarevgadaavksgagaadaireltggqga
    tavfdfvgaqstidtaqqvvavdghisvvgihagahakvgffmipfgasvvtpywgtrse
    lmevvalaragrldihtetftldegpaayrrlregsirgrgvvvp
    

    Sequence, based on observed residues (ATOM records):
    >2xaaA (A:)
    mkavqyteigsepvdiptptpgeillkvtaaglchsdifvmdmpaaqyyglpltlghegv
    gtvagfgvgdavavygpwgcgachacargrenyctraadlgitppglgspgsmaeymivd
    sarhlvpigdldpvaaapltdagltpyhaisrvlpllgpgstavvigvgglghvgiqilr
    avsaarviavdldddrlalarevgadaavksgagaadaireltggqgatavfdfvgaqst
    idtaqqvvavdghisvvgihagahakvgffmipfgasvvtpywgtrselmevvalaragr
    ldihtetftldegpaayrrlregsirgrgvvvp
    

  • Chain 'B':
    Sequence, based on SEQRES records:
    >2xaaB (B:)
    mkavqyteigsepvvvdiptptpgpgeillkvtaaglchsdifvmdmpaaqyayglpltl
    ghegvgtvaelgegvtgfgvgdavavygpwgcgachacargrenyctraadlgitppglg
    spgsmaeymivdsarhlvpigdldpvaaapltdagltpyhaisrvlpllgpgstavvigv
    gglghvgiqilravsaarviavdldddrlalarevgadaavksgagaadaireltggqga
    tavfdfvgaqstidtaqqvvavdghisvvgihagahakvgffmipfgasvvtpywgtrse
    lmevvalaragrldihtetftldegpaayrrlregsirgrgvvvp
    

    Sequence, based on observed residues (ATOM records):
    >2xaaB (B:)
    mkavqyteigsepvvvdiptptpggeillkvtaaglchsdifvmdmpaaqyayglpltlg
    hegvgtvelggvtgfgvgdavavygpwgcgachacargrenyctraadlgitppglgspg
    smaeymivdsarhlvpigdldpvaaapltdagltpyhaisrvlpllgpgstavvigvggl
    ghvgiqilravsaarviavdldddrlalarevgadaavksgagaadaireltggqgatav
    fdfvgaqstidtaqqvvavdghisvvgihagahakvgffmipfgasvvtpywgtrselme
    vvalaragrldihtetftldegpaayrrlregsirgrgvvvp
    

  • Chain 'C':
    Sequence, based on SEQRES records:
    >2xaaC (C:)
    mkavqyteigsepvvvdiptptpgpgeillkvtaaglchsdifvmdmpaaqyayglpltl
    ghegvgtvaelgegvtgfgvgdavavygpwgcgachacargrenyctraadlgitppglg
    spgsmaeymivdsarhlvpigdldpvaaapltdagltpyhaisrvlpllgpgstavvigv
    gglghvgiqilravsaarviavdldddrlalarevgadaavksgagaadaireltggqga
    tavfdfvgaqstidtaqqvvavdghisvvgihagahakvgffmipfgasvvtpywgtrse
    lmevvalaragrldihtetftldegpaayrrlregsirgrgvvvp
    

    Sequence, based on observed residues (ATOM records):
    >2xaaC (C:)
    mkavqyteigsepvvvdiptptpgpgeillkvtaaglchsdifvmdmpaaqyayglpltl
    ghegvgtvaelgegvtgfgvgdavavygpwgcgachacargrenyctraadlgitppglg
    spgsmaeymivdsarhlvpigdldpvaaapltdagltpyhaisrvlpllgpgstavvigv
    gglghvgiqilravsaarviavdldddrlalarevgadaavksgagaadaireltgggat
    avfdfvgaqstidtaqqvvavdghisvvgihagahakvgffmipfgasvvtpywgtrsel
    mevvalaragrldihtetftldegpaayrrlregsirgrgvvvp
    

  • Chain 'D':
    Sequence; same for both SEQRES and ATOM records:
    >2xaaD (D:)
    mkavqyteigsepvvvdiptptpgpgeillkvtaaglchsdifvmdmpaaqyayglpltl
    ghegvgtvaelgegvtgfgvgdavavygpwgcgachacargrenyctraadlgitppglg
    spgsmaeymivdsarhlvpigdldpvaaapltdagltpyhaisrvlpllgpgstavvigv
    gglghvgiqilravsaarviavdldddrlalarevgadaavksgagaadaireltggqga
    tavfdfvgaqstidtaqqvvavdghisvvgihagahakvgffmipfgasvvtpywgtrse
    lmevvalaragrldihtetftldegpaayrrlregsirgrgvvvp