PDB entry 4bnv

View 4bnv on RCSB PDB site
Description: Crystal structure of 3-oxoacyl-(acyl-carrier-protein) reductase (FabG) from Pseudomonas aeruginosa in complex with 1-(2-chlorophenyl)-3-(1- methylbenzimidazol-2-yl)urea at 2.5A resolution
Class: oxidoreductase
Keywords: oxidoreductase, rossmann fold, fatty acid biosynthesis
Deposited on 2013-05-17, released 2013-09-18
The last revision prior to the SCOPe 2.05 freeze date was dated 2013-11-27, with a file datestamp of 2013-11-22.
Experiment type: XRAY
Resolution: 2.5 Å
R-factor: 0.20685
AEROSPACI score: 0.26 (click here for full SPACI score report)

Chains and heterogens:

  • Chain 'A':
    Compound: 3-oxoacyl-[acyl-carrier-protein] reductase FabG
    Species: PSEUDOMONAS AERUGINOSA [TaxId:208964]
    Database cross-references and differences (RAF-indexed):
    • Uniprot O54438 (22-End)
      • expression tag (21)
    Domains in SCOPe 2.05: d4bnva_
  • Chain 'B':
    Compound: 3-oxoacyl-[acyl-carrier-protein] reductase FabG
    Species: PSEUDOMONAS AERUGINOSA [TaxId:208964]
    Database cross-references and differences (RAF-indexed): Domains in SCOPe 2.05: d4bnvb_
  • Chain 'C':
    Compound: 3-oxoacyl-[acyl-carrier-protein] reductase FabG
    Species: PSEUDOMONAS AERUGINOSA [TaxId:208964]
    Database cross-references and differences (RAF-indexed):
    • Uniprot O54438 (22-268)
      • expression tag (1-7)
      • expression tag (17-21)
    Domains in SCOPe 2.05: d4bnvc_
  • Chain 'D':
    Compound: 3-oxoacyl-[acyl-carrier-protein] reductase FabG
    Species: PSEUDOMONAS AERUGINOSA [TaxId:208964]
    Database cross-references and differences (RAF-indexed):
    • Uniprot O54438 (22-268)
      • expression tag (18-21)
    Domains in SCOPe 2.05: d4bnvd_
  • Heterogens: Q7U, HOH

PDB Chain Sequences:

  • Chain 'A':
    Sequence, based on SEQRES records: (download)
    >4bnvA (A:)
    mhhhhhhssgvdlgtenlyfqsmslqgkvalvtgasrgigqaialelgrlgavvigtats
    asgaekiaetlkangvegaglvldvssdesvaatlehiqqhlgqplivvnnagitrdnll
    vrmkddewfdvvntnlnslyrlskavlrgmtkarwgriinigsvvgamgnagqtnyaaak
    aglegftralarevgsraitvnavapgfidtdmtrelpeaqreallgqiplgrlgqaeei
    akvvgflasdgaayvtgatvpvnggmyms
    

    Sequence, based on observed residues (ATOM records): (download)
    >4bnvA (A:)
    smslqgkvalvtgasrgigqaialelgrlgavvigtatsasgaekiaetlkangvegagl
    vldvssdesvaatlehiqqhlgqplivvnnagiewfdvvntnlnslyrlskavlrgmtka
    rwgriinigsvvggqtnyaaakaglegftralarevgsraitvnavapgfidtdmtrelp
    eaqreallgqiplgrlgqaeeiakvvgflasdgaayvtgatvpvnggmym
    

  • Chain 'B':
    Sequence, based on SEQRES records: (download)
    >4bnvB (B:)
    mhhhhhhssgvdlgtenlyfqsmslqgkvalvtgasrgigqaialelgrlgavvigtats
    asgaekiaetlkangvegaglvldvssdesvaatlehiqqhlgqplivvnnagitrdnll
    vrmkddewfdvvntnlnslyrlskavlrgmtkarwgriinigsvvgamgnagqtnyaaak
    aglegftralarevgsraitvnavapgfidtdmtrelpeaqreallgqiplgrlgqaeei
    akvvgflasdgaayvtgatvpvnggmyms
    

    Sequence, based on observed residues (ATOM records): (download)
    >4bnvB (B:)
    mslqgkvalvtgasrgigqaialelgrlgavvigtatsasgaekiaetlkangvegaglv
    ldvssdesvaatlehiqqhlgqplivvnnagiewfdvvntnlnslyrlskavlrgmtkar
    wgriinigsvvggqtnyaaakaglegftralarevgsraitvnavapgfidtdmtrelpe
    aqreallgqiplgrlgqaeeiakvvgflasdgaayvtgatvpvnggmym
    

  • Chain 'C':
    Sequence, based on SEQRES records: (download)
    >4bnvC (C:)
    mhhhhhhssgvdlgtenlyfqsmslqgkvalvtgasrgigqaialelgrlgavvigtats
    asgaekiaetlkangvegaglvldvssdesvaatlehiqqhlgqplivvnnagitrdnll
    vrmkddewfdvvntnlnslyrlskavlrgmtkarwgriinigsvvgamgnagqtnyaaak
    aglegftralarevgsraitvnavapgfidtdmtrelpeaqreallgqiplgrlgqaeei
    akvvgflasdgaayvtgatvpvnggmyms
    

    Sequence, based on observed residues (ATOM records): (download)
    >4bnvC (C:)
    hhhhhhslyfqsmslqgkvalvtgasrgigqaialelgrlgavvigtatsasgaekiaet
    lkangvegaglvldvssdesvaatlehiqqhlgqplivvnnadewfdvvntnlnslyrls
    kavlrgmtkarwgriinigsvvgnagqtnyaaakaglegftralarevgsraitvnavap
    gfidtdmtrelpeaqreallgqiplgrlgqaeeiakvvgflasdgaayvtgatvpvnggm
    yms
    

  • Chain 'D':
    Sequence, based on SEQRES records: (download)
    >4bnvD (D:)
    mhhhhhhssgvdlgtenlyfqsmslqgkvalvtgasrgigqaialelgrlgavvigtats
    asgaekiaetlkangvegaglvldvssdesvaatlehiqqhlgqplivvnnagitrdnll
    vrmkddewfdvvntnlnslyrlskavlrgmtkarwgriinigsvvgamgnagqtnyaaak
    aglegftralarevgsraitvnavapgfidtdmtrelpeaqreallgqiplgrlgqaeei
    akvvgflasdgaayvtgatvpvnggmyms
    

    Sequence, based on observed residues (ATOM records): (download)
    >4bnvD (D:)
    yfqsmslqgkvalvtgasrgigqaialelgrlgavvigtatsasgaekiaetlkangveg
    aglvldvssdesvaatlehiqqhlgqplivvnnagmkddewfdvvntnlnslyrlskavl
    rgmtkarwgriinigsvvgamgnagqtnyaaakaglegftralarevgsraitvnavapg
    fidtdmtrelpeaqreallgqiplgrlgqaeeiakvvgflasdgaayvtgatvpvnggmy
    ms