PDB entry 3qub

View 3qub on RCSB PDB site
Description: Crystal structure of pyrophosphatase from bacteroides thetaiotaomicron, glu47ala mutant complexed with sulfate
Class: hydrolase
Keywords: HYDROLASE, PYROPHOSPHATASE, MAGNESIUM BIN NEW YORK SGX RESEARCH CENTER FOR STRUCTURAL GENOMICS, ENZYME FUNCTION INITIATIVE, EFI, PSI-2, Protein Structure Initiative, NYSGXRC
Deposited on 2011-02-23, released 2011-04-27
The last revision prior to the SCOPe 2.07 freeze date was dated 2011-11-16, with a file datestamp of 2011-11-11.
Experiment type: XRAY
Resolution: 1.9 Å
R-factor: 0.199
AEROSPACI score: 0.46 (click here for full SPACI score report)

Chains and heterogens:

  • Chain 'A':
    Compound: inorganic pyrophosphatase
    Species: Bacteroides thetaiotaomicron [TaxId:818]
    Gene: BT_2127
    Database cross-references and differences (RAF-indexed):
    • Uniprot Q8A5V9 (19-End)
      • engineered mutation (65)
    Domains in SCOPe 2.07: d3quba_
  • Heterogens: SO4, HOH

PDB Chain Sequences:

  • Chain 'A':
    Sequence, based on SEQRES records: (download)
    >3qubA (A:)
    gsshhhhhhssglvprgshmrkklkavlfdmdgvlfnsmpyhseawhqvmkthgldlsre
    eaymhagrtgastinivfqrelgkeatqeeiesiyheksilfnsypeaermpgawellqk
    vksegltpmvvtgsgqlsllerlehnfpgmfhkelmvtafdvkygkpnpepylmalkkgg
    lkadeavvienaplgveaghkagiftiavntgpldgqvlldagadllfpsmqtlcdswdt
    iml
    

    Sequence, based on observed residues (ATOM records): (download)
    >3qubA (A:)
    mrkklkavlfdmdgvlfnsmpyhseawhqvmkthgldlsreeaymhagrtgastinivfq
    relgkeatqeeiesiyheksilfnsypeaermpgawellqkvksegltpmvvtgsgqlsl
    lerlehnfpgmfhkelmvtafdvkygkpnpepylmalkkgglkadeavvienaplgveag
    hkagiftiavntgpldgqvlldagadllfpsmqtlcdswdtim