PDB entry 4kqq

View 4kqq on RCSB PDB site
Description: CRYSTAL STRUCTURE OF PENICILLIN-BINDING PROTEIN 3 FROM PSEUDOMONAS AERUGINOSA IN COMPLEX WITH (5S)-Penicilloic Acid
Class: Biosynthetic Protein/Antibiotic
Keywords: PENICILLIN-BINDING PROTEINS, PIPERACILLIN, (5S)-Penicilloic Acid, CELL WALL BIOSYNTHESIS, TRANSPEPTIDASE, OUT PERIPLASMIC MEMBRANE, Biosynthetic Protein, Biosynthetic Protein-Antibiotic Complex
Deposited on 2013-05-15, released 2013-11-06
The last revision prior to the SCOPe 2.07 freeze date was dated 2013-11-06, with a file datestamp of 2013-11-01.
Experiment type: XRAY
Resolution: 2.1 Å
R-factor: 0.206
AEROSPACI score: 0.33 (click here for full SPACI score report)

Chains and heterogens:

  • Chain 'A':
    Compound: penicillin-binding protein 3
    Species: PSEUDOMONAS AERUGINOSA [TaxId:208964]
    Gene: ftsI, PA4418
    Database cross-references and differences (RAF-indexed): Domains in SCOPe 2.07: d4kqqa1, d4kqqa2
  • Chain 'B':
    Compound: penicillin-binding protein 3
    Species: PSEUDOMONAS AERUGINOSA [TaxId:208964]
    Gene: ftsI, PA4418
    Database cross-references and differences (RAF-indexed): Domains in SCOPe 2.07: d4kqqb1, d4kqqb2
  • Heterogens: VPP, CL, GOL, IMD, HOH

PDB Chain Sequences:

  • Chain 'A':
    Sequence, based on SEQRES records: (download)
    >4kqqA (A:)
    mahhhhhhssglevlfqgpdlhvidhdflkgqgdarsvrhiaipahrglitdrngeplav
    stpvttlwanpkelmtakerwpqlaaalgqdtklfadrieqnaerefiylvrgltpeqge
    gvialkvpgvysieefrrfypagevvahavgftdvddrgregielafdewlagvpgkrqv
    lkdrrgrvikdvqvtknakpgktlalsidlrlqylahrelrnallengakagslvimdvk
    tgeilamtnqptynpnnrrnlqpaamrnramidvfepgstvkpfsmsaalasgrwkpsdi
    vdvypgtlqigrytirdvsrnsrqldltgilikssnvgiskiafdigaesiysvmqqvgl
    gqdtglgfpgervgnlpnhrkwpkaetatlaygyglsvtaiqlahayaalandgksvpls
    mtrvdrvpdgvqvispevastvqgmlqqvveaqggvfraqvpgyhaagksgtarkvsvgt
    kgyrenayrslfagfapatdpriamvvvidepskagyfgglvsapvfskvmagalrlmnv
    ppdnlptateqqqvnaapakggrg
    

    Sequence, based on observed residues (ATOM records): (download)
    >4kqqA (A:)
    rsvrhiaipahrglitdrngeplavstpvttlwanpkelmtakerwpqlaaalgqdtklf
    adrieqnaerefiylvrgltpeqgegvialkvpgvysieefrrfypagevvahavgftdv
    ddrgregielafdewlagvpgkrqvlkdrrgrvikdvqvtknakpgktlalsidlrlqyl
    ahrelrnallengakagslvimdvktgeilamtnqptynpnnrrnlqpaamrnramidvf
    epgstvkpfsmsaalasgrwkpsdivdvypgtlqigrytirdvsrnsrqldltgilikss
    nvgiskiafdigaesiysvmqqvglgqdtglgfpgervgnlpnhrkwpkaetatlaygyg
    lsvtaiqlahayaalandgksvplsmtrvdrvpdgvqvispevastvqgmlqqvveaqgg
    vfraqvpgyhaagksgtarkvsvgtkgyrenayrslfagfapatdpriamvvvidepska
    gyfgglvsapvfskvmagalrlmnvppdnlptateqqqvn
    

  • Chain 'B':
    Sequence, based on SEQRES records: (download)
    >4kqqB (B:)
    mahhhhhhssglevlfqgpdlhvidhdflkgqgdarsvrhiaipahrglitdrngeplav
    stpvttlwanpkelmtakerwpqlaaalgqdtklfadrieqnaerefiylvrgltpeqge
    gvialkvpgvysieefrrfypagevvahavgftdvddrgregielafdewlagvpgkrqv
    lkdrrgrvikdvqvtknakpgktlalsidlrlqylahrelrnallengakagslvimdvk
    tgeilamtnqptynpnnrrnlqpaamrnramidvfepgstvkpfsmsaalasgrwkpsdi
    vdvypgtlqigrytirdvsrnsrqldltgilikssnvgiskiafdigaesiysvmqqvgl
    gqdtglgfpgervgnlpnhrkwpkaetatlaygyglsvtaiqlahayaalandgksvpls
    mtrvdrvpdgvqvispevastvqgmlqqvveaqggvfraqvpgyhaagksgtarkvsvgt
    kgyrenayrslfagfapatdpriamvvvidepskagyfgglvsapvfskvmagalrlmnv
    ppdnlptateqqqvnaapakggrg
    

    Sequence, based on observed residues (ATOM records): (download)
    >4kqqB (B:)
    aipahrglitdrngeplavstpvttlwanpkelmtakerwpqlaaalgqdtklfadrieq
    naerefiylvrgltpeqgegvialkvpgvysieefrrfypagevvahavgftdvddrgre
    gielafdewlagvpgkrvtknakpgktlalsidlrlqylahrelrnallengakagslvi
    mdvktgeilamtnqptynpnnrrnlqpaamrnramidvfepgstvkpfsmsaalasgrwk
    psdivdvypgtlqigrytirdvsrnsrqldltgilikssnvgiskiafdigaesiysvmq
    qvglgqdtglgfpgervgnlpnhrkwpkaetatlaygyglsvtaiqlahayaalandgks
    vplsmtrvdrvpdgvqvispevastvqgmlqqvveaqggvfraqvpgyhaagksgtarkv
    svgtkgyrenayrslfagfapatdpriamvvvidepskagyfgglvsapvfskvmagalr
    lmnvppdnlptateqqqvn