PDB entry 2vsu

View 2vsu on RCSB PDB site
Description: a ternary complex of hydroxycinnamoyl-coa hydratase-lyase (hchl) with acetyl-coenzyme a and vanillin gives insights into substrate specificity and mechanism.
Class: lyase
Keywords: lyase, aldolase, crotonase, hydratase
Deposited on 2008-04-29, released 2008-05-27
The last revision prior to the SCOPe 2.08 freeze date was dated 2011-08-03, with a file datestamp of 2011-07-29.
Experiment type: XRAY
Resolution: 1.9 Å
R-factor: 0.191
AEROSPACI score: 0.48 (click here for full SPACI score report)

Chains and heterogens:

  • Chain 'A':
    Compound: p-hydroxycinnamoyl coa hydratase/lyase
    Species: PSEUDOMONAS FLUORESCENS [TaxId:294]
    Database cross-references and differences (RAF-indexed):
    • Uniprot O69762
      • engineered mutation (122)
    Domains in SCOPe 2.08: d2vsua_
  • Chain 'B':
    Compound: p-hydroxycinnamoyl coa hydratase/lyase
    Species: PSEUDOMONAS FLUORESCENS [TaxId:294]
    Database cross-references and differences (RAF-indexed):
    • Uniprot O69762
      • engineered mutation (122)
    Domains in SCOPe 2.08: d2vsub_
  • Chain 'C':
    Compound: p-hydroxycinnamoyl coa hydratase/lyase
    Species: PSEUDOMONAS FLUORESCENS [TaxId:294]
    Database cross-references and differences (RAF-indexed):
    • Uniprot O69762 (250-End)
      • engineered mutation (122)
    Domains in SCOPe 2.08: d2vsuc_
  • Chain 'D':
    Compound: p-hydroxycinnamoyl coa hydratase/lyase
    Species: PSEUDOMONAS FLUORESCENS [TaxId:294]
    Database cross-references and differences (RAF-indexed):
    • Uniprot O69762
      • engineered mutation (122)
    Domains in SCOPe 2.08: d2vsud_
  • Chain 'E':
    Compound: p-hydroxycinnamoyl coa hydratase/lyase
    Species: PSEUDOMONAS FLUORESCENS [TaxId:294]
    Database cross-references and differences (RAF-indexed):
    • Uniprot O69762
      • engineered mutation (122)
      • conflict (145)
    Domains in SCOPe 2.08: d2vsue_
  • Chain 'F':
    Compound: p-hydroxycinnamoyl coa hydratase/lyase
    Species: PSEUDOMONAS FLUORESCENS [TaxId:294]
    Database cross-references and differences (RAF-indexed):
    • Uniprot O69762
      • engineered mutation (122)
      • conflict (28)
    Domains in SCOPe 2.08: d2vsuf_
  • Heterogens: ACO, V55, HOH

PDB Chain Sequences:

  • Chain 'A':
    Sequence, based on SEQRES records: (download) 
    >2vsuA (A:)
mstyegrwktvkveiedgiafvilnrpekrnamsptlnremidvletleqdpaagvlvlt
gageawtagmdlkeyfrevdagpeilqekirreasqwqwkllrmyakptiamvngwcfgg
gfaplvacdlaicadeatfglseinwgippgnlvskamadtvghrqslyyimtgktfggq
kaaemglvnesvplaqlrevtielarnlleknpvvlraakhgfkrcreltweqnedylya
kldqsrlldteggreqgmkqflddksikpglqaykr

    Sequence, based on observed residues (ATOM records): (download) 
    >2vsuA (A:)
yegrwktvkveiedgiafvilnrpekrnamsptlnremidvletleqdpaagvlvltgag
eawtagmdlkeagpeilqekirreasqwqwkllrmyakptiamvngwcfgggfaplvacd
laicadeatfglseinwgippgnlvskamadtvghrqslyyimtgktfggqkaaemglvn
esvplaqlrevtielarnlleknpvvlraakhgfkrcreltweqnedylyakldqsrlld
t

  • Chain 'B':
    Sequence, based on SEQRES records: (download) 
    >2vsuB (B:)
mstyegrwktvkveiedgiafvilnrpekrnamsptlnremidvletleqdpaagvlvlt
gageawtagmdlkeyfrevdagpeilqekirreasqwqwkllrmyakptiamvngwcfgg
gfaplvacdlaicadeatfglseinwgippgnlvskamadtvghrqslyyimtgktfggq
kaaemglvnesvplaqlrevtielarnlleknpvvlraakhgfkrcreltweqnedylya
kldqsrlldteggreqgmkqflddksikpglqaykr

    Sequence, based on observed residues (ATOM records): (download) 
    >2vsuB (B:)
yegrwktvkveiedgiafvilnrpekrnamsptlnremidvletleqdpaagvlvltgag
eawtagmdlkeyfrevdagpeilqekirreasqwqwkllrmyakptiamvngwcfgggfa
plvacdlaicadeatfglseinwgippgnlvskamadtvghrqslyyimtgktfggqkaa
emglvnesvplaqlrevtielarnlleknpvvlraakhgfkrcreltweqnedylyakld
qsrlldte

  • Chain 'C':
    Sequence, based on SEQRES records: (download) 
    >2vsuC (C:)
mstyegrwktvkveiedgiafvilnrpekrnamsptlnremidvletleqdpaagvlvlt
gageawtagmdlkeyfrevdagpeilqekirreasqwqwkllrmyakptiamvngwcfgg
gfaplvacdlaicadeatfglseinwgippgnlvskamadtvghrqslyyimtgktfggq
kaaemglvnesvplaqlrevtielarnlleknpvvlraakhgfkrcreltweqnedylya
kldqsrlldtggreqgmkqflddksikpglqaykr

    Sequence, based on observed residues (ATOM records): (download) 
    >2vsuC (C:)
grwktvkveiedgiafvilnrpekrnamsptlnremidvletleqdpaagvlvltgagea
wtagmdlkeyfrevdagpeilqekirreasqwqwkllrmyakptiamvngwcfgggfapl
vacdlaicadeatfglseinwgippgnlvskamadtvghrqslyyimtgktfggqkaaem
glvnesvplaqlrevtielarnlleknpvvlraakhgfkrcreltweqnedylyakldqs
rlldtggreqg

  • Chain 'D':
    Sequence, based on SEQRES records: (download) 
    >2vsuD (D:)
mstyegrwktvkveiedgiafvilnrpekrnamsptlnremidvletleqdpaagvlvlt
gageawtagmdlkeyfrevdagpeilqekirreasqwqwkllrmyakptiamvngwcfgg
gfaplvacdlaicadeatfglseinwgippgnlvskamadtvghrqslyyimtgktfggq
kaaemglvnesvplaqlrevtielarnlleknpvvlraakhgfkrcreltweqnedylya
kldqsrlldteggreqgmkqflddksikpglqaykr

    Sequence, based on observed residues (ATOM records): (download) 
    >2vsuD (D:)
tyegrwktvkveiedgiafvilnrpekrnamsptlnremidvletleqdpaagvlvltga
geawtagmdlkeyfrevdagpeilqekirreasqwqwkllrmyakptiamvngwcfgggf
aplvacdlaicadeatfglseinwgippgnlvskamadtvghrqslyyimtgktfggqka
aemglvnesvplaqlrevtielarnlleknpvvlraakhgfkrcreltweqnedylyakl
dqsrlldt

  • Chain 'E':
    Sequence, based on SEQRES records: (download) 
    >2vsuE (E:)
mstyegrwktvkveiedgiafvilnrpekrnamsptlnremidvletleqdpaagvlvlt
gageawtagmdlkeyfrevdagpeilqekirreasqwqwkllrmyakptiamvngwcfgg
gfaplvacdlaicadeatfglseinygippgnlvskamadtvghrqslyyimtgktfggq
kaaemglvnesvplaqlrevtielarnlleknpvvlraakhgfkrcreltweqnedylya
kldqsrlldteggreqgmkqflddksikpglqaykr

    Sequence, based on observed residues (ATOM records): (download) 
    >2vsuE (E:)
tyegrwktvkveiedgiafvilnrpekrnamsptlnremidvletleqdpaagvlvltga
geawtagmdlkeyfrevgpeilqekirreasqwqwkllrmyakptiamvngwcfgggfap
lvacdlaicadeatfglseinygippgnlvskamadtvghrqslyyimtgktfggqkaae
mglvnesvplaqlrevtielarnlleknpvvlraakhgfkrcreltweqnedylyakldq
srlld

  • Chain 'F':
    Sequence, based on SEQRES records: (download) 
    >2vsuF (F:)
mstyegrwktvkveiedgiafvilnrperrnamsptlnremidvletleqdpaagvlvlt
gageawtagmdlkeyfrevdagpeilqekirreasqwqwkllrmyakptiamvngwcfgg
gfaplvacdlaicadeatfglseinwgippgnlvskamadtvghrqslyyimtgktfggq
kaaemglvnesvplaqlrevtielarnlleknpvvlraakhgfkrcreltweqnedylya
kldqsrlldteggreqgmkqflddksikpglqaykr

    Sequence, based on observed residues (ATOM records): (download) 
    >2vsuF (F:)
yegrwktvkveiedgiafvilnrperrnamsptlnremidvletleqdpaagvlvltgag
eawtagmdlkeyfrevdagpeilqekirreasqwqwkllrmyakptiamvngwcfgggfa
plvacdlaicadeatfglseinwgippgnlvskamadtvghrqslyyimtgktfggqkaa
emglvnesvplaqlrevtielarnlleknpvvlraakhgfkrcreltweqnedylyakld
qsrlld