PDB entry 4h6o

View 4h6o on RCSB PDB site
Description: Sterol 14-alpha demethylase (CYP51)from Trypanosoma cruzi in complex with the inhibitor NEU321 (1-(3-(4-chloro-3,5-dimethylphenoxy)benzyl)-1H-imidazole
Class: oxidoreductase/oxidoreductase inhibitor
Keywords: sterol 14-alpha demethylase (CYP51), cytochrome P450, heme, oxidoreductase, monooxygenase, sterol biosynthesis, eukaryotic membranes, cytochrome P450 fold, endoplasmic reticulum membrane, OXIDOREDUCTASE-OXIDOREDUCTASE INHIBITOR complex
Deposited on 2012-09-19, released 2013-03-20
The last revision prior to the SCOPe 2.08 freeze date was dated 2017-11-15, with a file datestamp of 2017-11-10.
Experiment type: XRAY
Resolution: 2.8 Å
R-factor: N/A
AEROSPACI score: 0.15 (click here for full SPACI score report)

Chains and heterogens:

  • Chain 'A':
    Compound: Sterol 14-alpha demethylase
    Species: Trypanosoma cruzi [TaxId:5693]
    Gene: cyp51
    Database cross-references and differences (RAF-indexed):
    • Uniprot Q7Z1V1 (2-End)
      • engineered mutation (1-3)
    Domains in SCOPe 2.08: d4h6oa1, d4h6oa2
  • Heterogens: HEM, NEE, HOH

PDB Chain Sequences:

  • Chain 'A':
    Sequence, based on SEQRES records: (download) 
    >4h6oA (A:)
makktppvypvtvpflghivqfgknplefmqrckrdlksgvftisiggqrvtivgdpheh
srffsprneilsprevytimtpvfgegvayaapyprmreqlnflaeeltiakfqnfvpai
qhevrkfmaenwkedegvinlledcgamiintacqclfgedlrkrlnarhfaqllskmes
slipaavfmpwllrlplpqsarcrearaelqkilgeiivarekeeaskdnntsdllggll
kavyrdgtrmslhevcgmivaamfagqhtstittswsmlhlmhpknkkwldklhkeidef
paqlnydnvmdempfaercvresirrdppllmvmrmvkaevkvgsyvvpkgdiiacspll
shhdeeafpnprlwdperdekvdgafigfgagvhkcigqkfallqvktilatafreydfq
llrdevpdpdyhtmvvgptlnqclvkytrkkklpshhhhhh

    Sequence, based on observed residues (ATOM records): (download) 
    >4h6oA (A:)
akktppvypvtvpflghivqfgknplefmqrckrdlksgvftisiggqrvtivgdphehs
rffsprneilsprevytimtpvfgegvayaapyprmreqlnflaeeltiakfqnfvpaiq
hevrkfmaenwkedegvinlledcgamiintacqclfgedlrkrlnarhfaqllskmess
lipaavfmlpqsarcrearaelqkilgeiivarekesdllggllkavyrdgtrmslhevc
gmivaamfagqhtstittswsmlhlmhpknkkwldklhkeidefpaqlnydnvmdempfa
ercvresirrdppllmvmrmvkaevkvgsyvvpkgdiiacspllshhdeeafpnprlwdp
erdekvdgafigfgagvhkcigqkfallqvktilatafreydfqllrdevpdpdyhtmvv
gptlnqclvkytrkk