PDB entry 2f1o

View 2f1o on RCSB PDB site
Description: Crystal Structure of NQO1 with Dicoumarol
Class: oxidoreductase/inhibitor
Keywords: Protein inhibitor, Structural Genomics, Israel Structural Proteomics Center, ISPC, OXIDOREDUCTASE, OXIDOREDUCTASE-INHIBITOR complex
Deposited on 2005-11-15, released 2006-05-16
The last revision prior to the SCOPe 2.08 freeze date was dated 2011-10-19, with a file datestamp of 2011-10-14.
Experiment type: XRAY
Resolution: 2.75 Å
R-factor: 0.219
AEROSPACI score: 0.26 (click here for full SPACI score report)

Chains and heterogens:

  • Chain 'A':
    Compound: nad(p)h dehydrogenase [quinone] 1
    Species: Homo sapiens [TaxId:9606]
    Gene: NQO1, DIA4, NMOR1
    Database cross-references and differences (RAF-indexed): Domains in SCOPe 2.08: d2f1oa_
  • Chain 'B':
    Compound: nad(p)h dehydrogenase [quinone] 1
    Species: Homo sapiens [TaxId:9606]
    Gene: NQO1, DIA4, NMOR1
    Database cross-references and differences (RAF-indexed): Domains in SCOPe 2.08: d2f1ob_
  • Chain 'C':
    Compound: nad(p)h dehydrogenase [quinone] 1
    Species: Homo sapiens [TaxId:9606]
    Gene: NQO1, DIA4, NMOR1
    Database cross-references and differences (RAF-indexed): Domains in SCOPe 2.08: d2f1oc_
  • Chain 'D':
    Compound: nad(p)h dehydrogenase [quinone] 1
    Species: Homo sapiens [TaxId:9606]
    Gene: NQO1, DIA4, NMOR1
    Database cross-references and differences (RAF-indexed): Domains in SCOPe 2.08: d2f1od_
  • Chain 'E':
    Compound: nad(p)h dehydrogenase [quinone] 1
    Species: Homo sapiens [TaxId:9606]
    Gene: NQO1, DIA4, NMOR1
    Database cross-references and differences (RAF-indexed): Domains in SCOPe 2.08: d2f1oe_
  • Chain 'F':
    Compound: nad(p)h dehydrogenase [quinone] 1
    Species: Homo sapiens [TaxId:9606]
    Gene: NQO1, DIA4, NMOR1
    Database cross-references and differences (RAF-indexed): Domains in SCOPe 2.08: d2f1of_
  • Chain 'G':
    Compound: nad(p)h dehydrogenase [quinone] 1
    Species: Homo sapiens [TaxId:9606]
    Gene: NQO1, DIA4, NMOR1
    Database cross-references and differences (RAF-indexed): Domains in SCOPe 2.08: d2f1og_
  • Chain 'H':
    Compound: nad(p)h dehydrogenase [quinone] 1
    Species: Homo sapiens [TaxId:9606]
    Gene: NQO1, DIA4, NMOR1
    Database cross-references and differences (RAF-indexed): Domains in SCOPe 2.08: d2f1oh_
  • Heterogens: DTC, FAD, HOH

PDB Chain Sequences:

  • Chain 'A':
    Sequence; same for both SEQRES and ATOM records: (download)
    >2f1oA (A:)
    vgrralivlahsertsfnyamkeaaaaalkkkgwevvesdlyamnfnpiisrkditgklk
    dpanfqypaesvlaykeghlspdivaeqkkleaadlvifqfplqwfgvpailkgwfervf
    igefaytyaamydkgpfrskkavlsittggsgsmyslqgihgdmnvilwpiqsgilhfcg
    fqvlepqltysightpadariqilegwkkrleniwdetplyfapsslfdlnfqagflmkk
    evqdeeknkkfglsvghhlgksiptdnqikark
    

  • Chain 'B':
    Sequence; same for both SEQRES and ATOM records: (download)
    >2f1oB (B:)
    vgrralivlahsertsfnyamkeaaaaalkkkgwevvesdlyamnfnpiisrkditgklk
    dpanfqypaesvlaykeghlspdivaeqkkleaadlvifqfplqwfgvpailkgwfervf
    igefaytyaamydkgpfrskkavlsittggsgsmyslqgihgdmnvilwpiqsgilhfcg
    fqvlepqltysightpadariqilegwkkrleniwdetplyfapsslfdlnfqagflmkk
    evqdeeknkkfglsvghhlgksiptdnqikark
    

  • Chain 'C':
    Sequence; same for both SEQRES and ATOM records: (download)
    >2f1oC (C:)
    vgrralivlahsertsfnyamkeaaaaalkkkgwevvesdlyamnfnpiisrkditgklk
    dpanfqypaesvlaykeghlspdivaeqkkleaadlvifqfplqwfgvpailkgwfervf
    igefaytyaamydkgpfrskkavlsittggsgsmyslqgihgdmnvilwpiqsgilhfcg
    fqvlepqltysightpadariqilegwkkrleniwdetplyfapsslfdlnfqagflmkk
    evqdeeknkkfglsvghhlgksiptdnqikark
    

  • Chain 'D':
    Sequence; same for both SEQRES and ATOM records: (download)
    >2f1oD (D:)
    vgrralivlahsertsfnyamkeaaaaalkkkgwevvesdlyamnfnpiisrkditgklk
    dpanfqypaesvlaykeghlspdivaeqkkleaadlvifqfplqwfgvpailkgwfervf
    igefaytyaamydkgpfrskkavlsittggsgsmyslqgihgdmnvilwpiqsgilhfcg
    fqvlepqltysightpadariqilegwkkrleniwdetplyfapsslfdlnfqagflmkk
    evqdeeknkkfglsvghhlgksiptdnqikark
    

  • Chain 'E':
    Sequence; same for both SEQRES and ATOM records: (download)
    >2f1oE (E:)
    vgrralivlahsertsfnyamkeaaaaalkkkgwevvesdlyamnfnpiisrkditgklk
    dpanfqypaesvlaykeghlspdivaeqkkleaadlvifqfplqwfgvpailkgwfervf
    igefaytyaamydkgpfrskkavlsittggsgsmyslqgihgdmnvilwpiqsgilhfcg
    fqvlepqltysightpadariqilegwkkrleniwdetplyfapsslfdlnfqagflmkk
    evqdeeknkkfglsvghhlgksiptdnqikark
    

  • Chain 'F':
    Sequence; same for both SEQRES and ATOM records: (download)
    >2f1oF (F:)
    vgrralivlahsertsfnyamkeaaaaalkkkgwevvesdlyamnfnpiisrkditgklk
    dpanfqypaesvlaykeghlspdivaeqkkleaadlvifqfplqwfgvpailkgwfervf
    igefaytyaamydkgpfrskkavlsittggsgsmyslqgihgdmnvilwpiqsgilhfcg
    fqvlepqltysightpadariqilegwkkrleniwdetplyfapsslfdlnfqagflmkk
    evqdeeknkkfglsvghhlgksiptdnqikark
    

  • Chain 'G':
    Sequence; same for both SEQRES and ATOM records: (download)
    >2f1oG (G:)
    vgrralivlahsertsfnyamkeaaaaalkkkgwevvesdlyamnfnpiisrkditgklk
    dpanfqypaesvlaykeghlspdivaeqkkleaadlvifqfplqwfgvpailkgwfervf
    igefaytyaamydkgpfrskkavlsittggsgsmyslqgihgdmnvilwpiqsgilhfcg
    fqvlepqltysightpadariqilegwkkrleniwdetplyfapsslfdlnfqagflmkk
    evqdeeknkkfglsvghhlgksiptdnqikark
    

  • Chain 'H':
    Sequence; same for both SEQRES and ATOM records: (download)
    >2f1oH (H:)
    vgrralivlahsertsfnyamkeaaaaalkkkgwevvesdlyamnfnpiisrkditgklk
    dpanfqypaesvlaykeghlspdivaeqkkleaadlvifqfplqwfgvpailkgwfervf
    igefaytyaamydkgpfrskkavlsittggsgsmyslqgihgdmnvilwpiqsgilhfcg
    fqvlepqltysightpadariqilegwkkrleniwdetplyfapsslfdlnfqagflmkk
    evqdeeknkkfglsvghhlgksiptdnqikark