PDB entry 4cl6

View 4cl6 on RCSB PDB site
Description: Crystal Structure of 3-hydroxydecanoyl-Acyl Carrier Protein Dehydratase (FabA) from Pseudomonas aeruginosa in complex with N-(4- Chlorobenzyl)-3-(2-furyl)-1H-1,2,4-triazol-5-amine
Class: lyase
Keywords: lyase, fatty acid biosynthesis, bacterial virulence, drug discovery
Deposited on 2014-01-13, released 2015-01-21
The last revision prior to the SCOPe 2.07 freeze date was dated 2016-03-02, with a file datestamp of 2016-02-26.
Experiment type: XRAY
Resolution: 2.41 Å
R-factor: N/A
AEROSPACI score: 0.23 (click here for full SPACI score report)

Chains and heterogens:

  • Chain 'A':
    Compound: 3-hydroxydecanoyl-[acyl-carrier-protein] dehydratase
    Species: Pseudomonas aeruginosa PAO1 [TaxId:208964]
    Database cross-references and differences (RAF-indexed): Domains in SCOPe 2.07: d4cl6a_
  • Chain 'B':
    Compound: 3-hydroxydecanoyl-[acyl-carrier-protein] dehydratase
    Species: Pseudomonas aeruginosa PAO1 [TaxId:208964]
    Database cross-references and differences (RAF-indexed): Domains in SCOPe 2.07: d4cl6b_
  • Chain 'C':
    Compound: 3-hydroxydecanoyl-[acyl-carrier-protein] dehydratase
    Species: Pseudomonas aeruginosa PAO1 [TaxId:208964]
    Database cross-references and differences (RAF-indexed): Domains in SCOPe 2.07: d4cl6c_
  • Chain 'D':
    Compound: 3-hydroxydecanoyl-[acyl-carrier-protein] dehydratase
    Species: Pseudomonas aeruginosa PAO1 [TaxId:208964]
    Database cross-references and differences (RAF-indexed): Domains in SCOPe 2.07: d4cl6d_
  • Chain 'E':
    Compound: 3-hydroxydecanoyl-[acyl-carrier-protein] dehydratase
    Species: Pseudomonas aeruginosa PAO1 [TaxId:208964]
    Database cross-references and differences (RAF-indexed): Domains in SCOPe 2.07: d4cl6e_
  • Heterogens: 7SB, HOH

PDB Chain Sequences:

  • Chain 'A':
    Sequence, based on SEQRES records: (download) 
    >4cl6A (A:)
mtkqhaftredllrcsrgelfgpgnaqlpapnmlmidrivhisdvggkygkgelvaeldi
npdlwffachfegdpvmpgclgldamwqlvgfylgwqgnpgrgralgsgevkffgqvlpt
akkvtynihikrtinrslvlaiadgtvsvdgreiysaeglrvglftstdsf

    Sequence, based on observed residues (ATOM records): (download) 
    >4cl6A (A:)
tkqhaftredllrcsrgelfgpgnaqlpapnmlmidrivhisdvggkygkgelvaeldin
pdlwffachfegdpvmpgclgldamwqlvgfylgwqgnpgrgralgsgevkffgqvlpta
kkvtynihikrtinlvlaiadgtvsvdgreiysaeglrvglftstdsf

  • Chain 'B':
    Sequence, based on SEQRES records: (download) 
    >4cl6B (B:)
mtkqhaftredllrcsrgelfgpgnaqlpapnmlmidrivhisdvggkygkgelvaeldi
npdlwffachfegdpvmpgclgldamwqlvgfylgwqgnpgrgralgsgevkffgqvlpt
akkvtynihikrtinrslvlaiadgtvsvdgreiysaeglrvglftstdsf

    Sequence, based on observed residues (ATOM records): (download) 
    >4cl6B (B:)
tkqhaftredllrcsrgelfgpgnaqlpapnmlmidrivhisdvggkygkgelvaeldin
pdlwffachfegdpvmpgclgldamwqlvgfylgwqgnpgrgralgsgevkffgqvlpta
kkvtynihikrtinrslvlaiadgtvsvdgreiysaeglrvglftstdsf

  • Chain 'C':
    Sequence; same for both SEQRES and ATOM records: (download) 
    >4cl6C (C:)
mtkqhaftredllrcsrgelfgpgnaqlpapnmlmidrivhisdvggkygkgelvaeldi
npdlwffachfegdpvmpgclgldamwqlvgfylgwqgnpgrgralgsgevkffgqvlpt
akkvtynihikrtinrslvlaiadgtvsvdgreiysaeglrvglftstdsf

  • Chain 'D':
    Sequence, based on SEQRES records: (download) 
    >4cl6D (D:)
mtkqhaftredllrcsrgelfgpgnaqlpapnmlmidrivhisdvggkygkgelvaeldi
npdlwffachfegdpvmpgclgldamwqlvgfylgwqgnpgrgralgsgevkffgqvlpt
akkvtynihikrtinrslvlaiadgtvsvdgreiysaeglrvglftstdsf

    Sequence, based on observed residues (ATOM records): (download) 
    >4cl6D (D:)
tkqhaftredllrcsrgelfgpgnaqlpapnmlmidrivhisdvggkygkgelvaeldin
pdlwffachfegdpvmpgclgldamwqlvgfylgwqgnpgrgralgsgevkffgqvlpta
kkvtynihikrtinrslvlaiadgtvsvdgreiysaeglrvglftstdsf

  • Chain 'E':
    Sequence, based on SEQRES records: (download) 
    >4cl6E (E:)
mtkqhaftredllrcsrgelfgpgnaqlpapnmlmidrivhisdvggkygkgelvaeldi
npdlwffachfegdpvmpgclgldamwqlvgfylgwqgnpgrgralgsgevkffgqvlpt
akkvtynihikrtinrslvlaiadgtvsvdgreiysaeglrvglftstdsf

    Sequence, based on observed residues (ATOM records): (download) 
    >4cl6E (E:)
tkqhaftredllrcsrgelfgpgnaqlpapnmlmidrivhisdvggkygkgelvaeldin
pdlwffachfegdpvmpgclgldamwqlvgfylgwqgnpgrgralgsgevkffgqvlpta
kkvtynihikrtinrslvlaiadgtvsvdgreiysaeglrvglftstdsf