PDB entry 3ch9

View 3ch9 on RCSB PDB site
Description: Crystal structure of Aspergillus fumigatus chitinase B1 in complex with dimethylguanylurea
Class: HYDROLASE/HYDROLASE inhibitor
Keywords: (beta-alpha)8 barrel, chitinase, peptide inhibitors, hydrolase, Glycosidase, HYDROLASE-HYDROLASE inhibitor complex
Deposited on 2008-03-09, released 2008-03-25
The last revision prior to the SCOPe 2.06 freeze date was dated 2011-07-13, with a file datestamp of 2011-05-08.
Experiment type: XRAY
Resolution: 2.2 Å
R-factor: 0.187
AEROSPACI score: 0.41 (click here for full SPACI score report)

Chains and heterogens:

  • Chain 'A':
    Compound: chitinase
    Species: Aspergillus fumigatus [TaxId:5085]
    Gene: chiB1
    Database cross-references and differences (RAF-indexed): Domains in SCOPe 2.06: d3ch9a1, d3ch9a2
  • Chain 'B':
    Compound: chitinase
    Species: Aspergillus fumigatus [TaxId:5085]
    Gene: chiB1
    Database cross-references and differences (RAF-indexed): Domains in SCOPe 2.06: d3ch9b1, d3ch9b2
  • Heterogens: SO4, XRG, HOH

PDB Chain Sequences:

  • Chain 'A':
    Sequence, based on SEQRES records: (download)
    >3ch9A (A:)
    mrfatstivkvalllsslcvdaavmwnrdtsstdlearassgyrsvvyfvnwaiygrnhn
    pqdlpverlthvlyafanvrpetgevymtdswadiekhypgdswsdtgnnvygcikqlyl
    lkkqnrnlkvllsiggwtyspnfapaastdagrknfaktavkllqdlgfdgldidweype
    ndqqandfvlllkevrtaldsysaanaggqhflltvaspagpdkikvlhlkdmdqqldfw
    nlmaydyagsfsslsghqanvyndtsnplstpfntqtaldlyraggvpankivlgmplyg
    rsfantdgpgkpyngvgqgswengvwdykalpqagatehvlpdimasysydatnkflisy
    dnpqvanlksgyikslglggamwwdsssdktgsdslittvvnalggtgvfeqsqneldyp
    vsqydnlrngmqt
    

    Sequence, based on observed residues (ATOM records): (download)
    >3ch9A (A:)
    assgyrsvvyfvnwaiygrnhnpqdlpverlthvlyafanvrpetgevymtdswadiekh
    ypgdswsdtgnnvygcikqlyllkkqnrnlkvllsiggwtyspnfapaastdagrknfak
    tavkllqdlgfdgldidweypendqqandfvlllkevrtaldsysaanaggqhflltvas
    pagpdkikvlhlkdmdqqldfwnlmaydyagsfsslsghqanvyndtsnplstpfntqta
    ldlyraggvpankivlgmplygrsfantdgpgkpyngvgqgswengvwdykalpqagate
    hvlpdimasysydatnkflisydnpqvanlksgyikslglggamwwdsssdktgsdslit
    tvvnalggtgvfeqsqneldypvsqydnlrngmqt
    

  • Chain 'B':
    Sequence, based on SEQRES records: (download)
    >3ch9B (B:)
    mrfatstivkvalllsslcvdaavmwnrdtsstdlearassgyrsvvyfvnwaiygrnhn
    pqdlpverlthvlyafanvrpetgevymtdswadiekhypgdswsdtgnnvygcikqlyl
    lkkqnrnlkvllsiggwtyspnfapaastdagrknfaktavkllqdlgfdgldidweype
    ndqqandfvlllkevrtaldsysaanaggqhflltvaspagpdkikvlhlkdmdqqldfw
    nlmaydyagsfsslsghqanvyndtsnplstpfntqtaldlyraggvpankivlgmplyg
    rsfantdgpgkpyngvgqgswengvwdykalpqagatehvlpdimasysydatnkflisy
    dnpqvanlksgyikslglggamwwdsssdktgsdslittvvnalggtgvfeqsqneldyp
    vsqydnlrngmqt
    

    Sequence, based on observed residues (ATOM records): (download)
    >3ch9B (B:)
    assgyrsvvyfvnwaiygrnhnpqdlpverlthvlyafanvrpetgevymtdswadiekh
    ypgdswsdtgnnvygcikqlyllkkqnrnlkvllsiggwtyspnfapaastdagrknfak
    tavkllqdlgfdgldidweypendqqandfvlllkevrtaldsysaanaggqhflltvas
    pagpdkikvlhlkdmdqqldfwnlmaydyagsfsslsghqanvyndtsnplstpfntqta
    ldlyraggvpankivlgmplygrsfantdgpgkpyngvgqgswengvwdykalpqagate
    hvlpdimasysydatnkflisydnpqvanlksgyikslglggamwwdsssdktgsdslit
    tvvnalggtgvfeqsqneldypvsqydnlrngmq