PDB entry 3ua5

View 3ua5 on RCSB PDB site
Description: Crystal Structure of P450 2B6 (Y226H/K262R) in complex with two molecules of Amlodipine
Class: oxidoreductase
Keywords: P450, human cytochrome P450 2B6, monooxygenase, oxidoreductase, membrane protein, CYP 2B6
Deposited on 2011-10-21, released 2012-09-12
The last revision prior to the SCOPe 2.07 freeze date was dated 2012-10-03, with a file datestamp of 2012-09-28.
Experiment type: XRAY
Resolution: 2.8 Å
R-factor: 0.245
AEROSPACI score: 0.22 (click here for full SPACI score report)

Chains and heterogens:

  • Chain 'A':
    Compound: Cytochrome P450 2B6
    Species: Homo sapiens [TaxId:9606]
    Gene: CYP2B6
    Database cross-references and differences (RAF-indexed):
    • Uniprot P20813 (9-471)
      • engineered mutation (8-9)
      • engineered mutation (206)
      • engineered mutation (242)
      • expression tag (472)
    Domains in SCOPe 2.07: d3ua5a1, d3ua5a2
  • Chain 'B':
    Compound: Cytochrome P450 2B6
    Species: Homo sapiens [TaxId:9606]
    Gene: CYP2B6
    Database cross-references and differences (RAF-indexed):
    • Uniprot P20813 (9-471)
      • engineered mutation (9)
      • engineered mutation (206)
      • engineered mutation (242)
      • expression tag (472)
    Domains in SCOPe 2.07: d3ua5b1, d3ua5b2
  • Heterogens: HEM, 06X, HOH

PDB Chain Sequences:

  • Chain 'A':
    Sequence, based on SEQRES records: (download) 
    >3ua5A (A:)
makktsskgklppgprplpllgnllqmdrrgllksflrfrekygdvftvhlgprpvvmlc
gveairealvdkaeafsgrgkiamvdpffrgygvifangnrwkvlrrfsvttmrdfgmgk
rsveeriqeeaqclieelrkskgalmdptflfqsitaniicsivfgkrfhyqdqeflkml
nlfyqtfslissvfgqlfelfsgflkhfpgahrqvyknlqeinayighsvekhretldps
aprdlidtyllhmekeksnahsefshqnlnlntlslffagtettsttlrygfllmlkyph
vaervyreieqvigphrppelhdrakmpyteaviyeiqrfsdllpmgvphivtqhtsfrg
yiipkdtevflilstalhdphyfekpdafnpdhfldangalkkteafipfslgkriclge
giaraelflffttilqnfsmaspvapedidltpqecgvgkipptyqirflprhhhh

    Sequence, based on observed residues (ATOM records): (download) 
    >3ua5A (A:)
gklppgprplpllgnllqmdrrgllksflrfrekygdvftvhlgprpvvmlcgveairea
lvdkaeafsgrgkiamvdpffrgygvifangnrwkvlrrfsvttmrdfgmgkrsveeriq
eeaqclieelrkskgalmdptflfqsitaniicsivfgkrfhyqdqeflkmlnlfyqtfs
lissvfgqlfelfsgflkhfpgahrqvyknlqeinayighsvekhretldpsaprdlidt
yllhmekeksnahsefshqnlnlntlslffagtettsttlrygfllmlkyphvaervyre
ieqvigphrppelhdrakmpyteaviyeiqrfsdllpmgvphivtqhtsfrgyiipkdte
vflilstalhdphyfekpdafnpdhfldangalkkteafipfslgkriclgegiaraelf
lffttilqnfsmaspvapedidltpqecgvgkipptyqirflprh

  • Chain 'B':
    Sequence, based on SEQRES records: (download) 
    >3ua5B (B:)
makktsskgklppgprplpllgnllqmdrrgllksflrfrekygdvftvhlgprpvvmlc
gveairealvdkaeafsgrgkiamvdpffrgygvifangnrwkvlrrfsvttmrdfgmgk
rsveeriqeeaqclieelrkskgalmdptflfqsitaniicsivfgkrfhyqdqeflkml
nlfyqtfslissvfgqlfelfsgflkhfpgahrqvyknlqeinayighsvekhretldps
aprdlidtyllhmekeksnahsefshqnlnlntlslffagtettsttlrygfllmlkyph
vaervyreieqvigphrppelhdrakmpyteaviyeiqrfsdllpmgvphivtqhtsfrg
yiipkdtevflilstalhdphyfekpdafnpdhfldangalkkteafipfslgkriclge
giaraelflffttilqnfsmaspvapedidltpqecgvgkipptyqirflprhhhh

    Sequence, based on observed residues (ATOM records): (download) 
    >3ua5B (B:)
klppgprplpllgnllqmdrrgllksflrfrekygdvftvhlgprpvvmlcgveaireal
vdkaeafsgrgkiamvdpffrgygvifangnrwkvlrrfsvttmrdfgmgkrsveeriqe
eaqclieelrkskgalmdptflfqsitaniicsivfgkrfhyqdqeflkmlnlfyqtfsl
issvfgqlfelfsgflkhfpgahrqvyknlqeinayighsvekhretldpsaprdlidty
llhmekeksnaefshqnlnlntlslffagtettsttlrygfllmlkyphvaervyreieq
vigphrppelhdrakmpyteaviyeiqrfsdllpmgvphivtqhtsfrgyiipkdtevfl
ilstalhdphyfekpdafnpdhfldangalkkteafipfslgkriclgegiaraelflff
ttilqnfsmaspvapedidltpqecgvgkipptyqirflprh