PDB entry 3kee

View 3kee on RCSB PDB site
Description: HCV NS3/NS4A complexed with Non-covalent macrocyclic compound TMC435
Class: hydrolase
Keywords: HCV, NS3, NS4A, macrocycle, noncovalent, TMC435, HYDROLASE
Deposited on 2009-10-26, released 2010-03-09
The last revision prior to the SCOPe 2.08 freeze date was dated 2010-03-09, with a file datestamp of 2010-03-05.
Experiment type: XRAY
Resolution: 2.4 Å
R-factor: 0.199
AEROSPACI score: 0.31 (click here for full SPACI score report)

Chains and heterogens:

  • Chain 'A':
    Compound: Genome polyprotein
    Species: Hepatitis C virus [TaxId:11103]
    Database cross-references and differences (RAF-indexed): Domains in SCOPe 2.08: d3keea_
  • Chain 'B':
    Compound: Genome polyprotein
    Species: Hepatitis C virus [TaxId:11103]
    Database cross-references and differences (RAF-indexed): Domains in SCOPe 2.08: d3keeb_
  • Chain 'C':
    Compound: Genome polyprotein
    Species: Hepatitis C virus [TaxId:11103]
    Database cross-references and differences (RAF-indexed): Domains in SCOPe 2.08: d3keec_
  • Chain 'D':
    Compound: Genome polyprotein
    Species: Hepatitis C virus [TaxId:11103]
    Database cross-references and differences (RAF-indexed): Domains in SCOPe 2.08: d3keed_
  • Chain 'E':
    Compound: 19-mer peptide from Genome polyprotein
    Species: Hepatitis C virus, synthetic [TaxId:11103]
    Database cross-references and differences (RAF-indexed):
    • Uniprot Q6GYR8 (2-End)
      • expression tag (1)
  • Chain 'F':
    Compound: 19-mer peptide from Genome polyprotein
    Species: Hepatitis C virus, synthetic [TaxId:11103]
    Database cross-references and differences (RAF-indexed):
    • Uniprot Q6GYR8 (2-End)
      • expression tag (1)
  • Chain 'G':
    Compound: 19-mer peptide from Genome polyprotein
    Species: Hepatitis C virus, synthetic [TaxId:11103]
    Database cross-references and differences (RAF-indexed):
    • Uniprot Q6GYR8 (2-End)
      • expression tag (1)
  • Chain 'H':
    Compound: 19-mer peptide from Genome polyprotein
    Species: Hepatitis C virus, synthetic [TaxId:11103]
    Database cross-references and differences (RAF-indexed):
    • Uniprot Q6GYR8 (2-End)
      • expression tag (1)
  • Heterogens: 30B, ZN, GOL, HOH

PDB Chain Sequences:

  • Chain 'A':
    Sequence, based on SEQRES records: (download) 
    >3keeA (A:)
mapitaysqqtrgllgciitsltgrdknqvegevqvvstatqsflatcvngvcwtvyhga
gsktlagpkgpitqmytnvdqdlvgwqappgarsltpctcgssdlylvtrhadvipvrrr
gdsrgsllsprpvsylkgssggpllcpsghavgifraavctrgvakavdfvpvesmettm
rsgshhhhhh

    Sequence, based on observed residues (ATOM records): (download) 
    >3keeA (A:)
itaysqqtrgllgciitsltgrdknqvegevqvvstatqsflatcvngvcwtvyhgagsk
tlagpkgpitqmytnvdqdlvgwqappgarsltpctcgssdlylvtrhadvipvrrrgds
rgsllsprpvsylkgssggpllcpsghavgifraavctrgvakavdfvpvesmettmr

  • Chain 'B':
    Sequence, based on SEQRES records: (download) 
    >3keeB (B:)
mapitaysqqtrgllgciitsltgrdknqvegevqvvstatqsflatcvngvcwtvyhga
gsktlagpkgpitqmytnvdqdlvgwqappgarsltpctcgssdlylvtrhadvipvrrr
gdsrgsllsprpvsylkgssggpllcpsghavgifraavctrgvakavdfvpvesmettm
rsgshhhhhh

    Sequence, based on observed residues (ATOM records): (download) 
    >3keeB (B:)
itaysqqtrgllgciitsltgrdknqvegevqvvstatqsflatcvngvcwtvyhgagsk
tlagpkgpitqmytnvdqdlvgwqappgarsltpctcgssdlylvtrhadvipvrrrgds
rgsllsprpvsylkgssggpllcpsghavgifraavctrgvakavdfvpvesmettmr

  • Chain 'C':
    Sequence, based on SEQRES records: (download) 
    >3keeC (C:)
mapitaysqqtrgllgciitsltgrdknqvegevqvvstatqsflatcvngvcwtvyhga
gsktlagpkgpitqmytnvdqdlvgwqappgarsltpctcgssdlylvtrhadvipvrrr
gdsrgsllsprpvsylkgssggpllcpsghavgifraavctrgvakavdfvpvesmettm
rsgshhhhhh

    Sequence, based on observed residues (ATOM records): (download) 
    >3keeC (C:)
itaysqqtrgllgciitsltgrdknqvegevqvvstatqsflatcvngvcwtvyhgagsk
tlagpkgpitqmytnvdqdlvgwqappgarsltpctcgssdlylvtrhadvipvrrrgds
rgsllsprpvsylkgssggpllcpsghavgifraavctrgvakavdfvpvesmettmr

  • Chain 'D':
    Sequence, based on SEQRES records: (download) 
    >3keeD (D:)
mapitaysqqtrgllgciitsltgrdknqvegevqvvstatqsflatcvngvcwtvyhga
gsktlagpkgpitqmytnvdqdlvgwqappgarsltpctcgssdlylvtrhadvipvrrr
gdsrgsllsprpvsylkgssggpllcpsghavgifraavctrgvakavdfvpvesmettm
rsgshhhhhh

    Sequence, based on observed residues (ATOM records): (download) 
    >3keeD (D:)
itaysqqtrgllgciitsltgrdknqvegevqvvstatqsflatcvngvcwtvyhgagsk
tlagpkgpitqmytnvdqdlvgwqappgarsltpctcgssdlylvtrhadvipvrrrgds
rgsllsprpvsylkgssggpllcpsghavgifraavctrgvakavdfvpvesmettmr

  • Chain 'E':
    No sequence available.

  • Chain 'F':
    No sequence available.

  • Chain 'G':
    No sequence available.

  • Chain 'H':
    No sequence available.