PDB entry 4c0c

View 4c0c on RCSB PDB site
Description: Crystal structure of Trypanosoma cruzi CYP51 bound to the inhibitor (R)-N-(3-(1H-indol-3-yl)-1-oxo-1-(pyridin-4-ylamino)propan-2-yl)-4-(4-(2,4-difluorophenyl)piperazin-1-yl)-2-fluorobenzamide.
Class: oxidoreductase
Keywords: oxidoreductase, sterol biosynthesis, chagas disease
Deposited on 2013-08-01, released 2014-08-20
The last revision prior to the SCOPe 2.07 freeze date was dated 2014-09-10, with a file datestamp of 2014-09-05.
Experiment type: XRAY
Resolution: 2.04 Å
R-factor: 0.20195
AEROSPACI score: 0.35 (click here for full SPACI score report)

Chains and heterogens:

  • Chain 'A':
    Compound: Sterol 14-alpha demethylase
    Species: Trypanosoma cruzi [TaxId:5693]
    Database cross-references and differences (RAF-indexed):
    • Uniprot Q5I4E1 (11-End)
      • expression tag (8-10)
    Domains in SCOPe 2.07: d4c0ca1, d4c0ca2
  • Heterogens: HEM, WVH, SO4, GOL, HOH

PDB Chain Sequences:

  • Chain 'A':
    Sequence, based on SEQRES records: (download) 
    >4c0cA (A:)
makktsskgklppvypvtvpflghivqfgknplefmqrckrdlksgvftisiggqrvtiv
gdphehsrffsprneilsprevytimtpvfgegvayaapyprmreqlnflaeeltiakfq
nfvpaiqhevrkfmaenwkedegvinlledcgamiintacqclfgedlrkrlnarhfaql
lskmesslipaavfmpwllrlplpqsarcrearaelqkilgeiivarekeeaskdnntsd
llggllkavyrdgtrmslhevcgmivaamfagqhtstittswsmlhlmhpknkkwldklh
keidefpaqlnydnvmdempfaercvresirrdppllmvmrmvkaevkvgsyvvpkgdii
acspllshhdeeafpnprlwdperdekvdgafigfgagvhkcigqkfallqvktilataf
reydfqllrdevpdpdyhtmvvgptlnqclvkytrkkklpshhhhhh

    Sequence, based on observed residues (ATOM records): (download) 
    >4c0cA (A:)
gklppvypvtvpflghivqfgknplefmqrckrdlksgvftisiggqrvtivgdphehsr
ffsprneilsprevytimtpvfgegvayaapyprmreqlnflaeeltiakfqnfvpaiqh
evrkfmaenwkedegvinlledcgamiintacqclfgedlrkrlnarhfaqllskmessl
ipaavfmpwllrlplpqsarcrearaelqkilgeiivarekeeastsdllggllkavyrd
gtrmslhevcgmivaamfagqhtstittswsmlhlmhpknkkwldklhkeidefpaqlny
dnvmdempfaercvresirrdppllmvmrmvkaevkvgsyvvpkgdiiacspllshhdee
afpnprlwdperdekvdgafigfgagvhkcigqkfallqvktilatafreydfqllrdev
pdpdyhtmvvgptlnqclvkytrkkk