PDB entry 4ool

View 4ool on RCSB PDB site
Description: Crystal structure of PBP3 in complex with compound 14 ((2E)-2-({[(2S)-2-{[(2Z)-2-(2-amino-1,3-thiazol-4-yl)-2-{[(1,5-dihydroxy-4-oxo-1,4-dihydropyridin-2-yl)methoxy]imino}acetyl]amino}-3-oxopropyl]oxy}imino)pentanedioic acid)
Class: transferase/transferase inhibitor
Keywords: PBP3, transferase-transferase inhibitor complex
Deposited on 2014-02-03, released 2014-05-07
The last revision prior to the SCOPe 2.08 freeze date was dated 2014-05-21, with a file datestamp of 2014-05-16.
Experiment type: XRAY
Resolution: 2.3 Å
R-factor: 0.189
AEROSPACI score: 0.3 (click here for full SPACI score report)

Chains and heterogens:

  • Chain 'A':
    Compound: Cell division protein FtsI [Peptidoglycan synthetase]
    Species: Pseudomonas aeruginosa PA1R [TaxId:1279008]
    Gene: PA1R_gp2318
    Database cross-references and differences (RAF-indexed): Domains in SCOPe 2.08: d4oola1, d4oola2
  • Heterogens: 2U2, HOH

PDB Chain Sequences:

  • Chain 'A':
    Sequence, based on SEQRES records: (download) 
    >4oolA (A:)
mghhhhhharsvrhiaipahrglitdrngeplavstpvttlwanpkelmtakerwpqlaa
algqdtklfadrieqnaerefiylvrgltpeqgegvialkvpgvysieefrrfypagevv
ahavgftdvddrgregielafdewlagvpgkrqvlkdrrgrvikdvqvtknakpgktlal
sidlrlqylahrelrnallengakagslvimdvktgeilamtnqptynpnnrrnlqpaam
rnramidvfepgstvkpfsmsaalasgrwkpsdivdvypgtlqigrytirdvsrnsrqld
ltgilikssnvgiskiafdigaesiysvmqqvglgqdtglgfpgervgnlpnhrkwpkae
tatlaygyglsvtaiqlahayaalandgksvplsmtrvdrvpdgvqvispevastvqgml
qqvveaqggvfraqvpgyhaagksgtarkvsvgtkgyrenayrslfagfapatdpriamv
vvidepskagyfgglvsapvfskvmagalrlmnvppdnlptateqqqvnaapakggrg

    Sequence, based on observed residues (ATOM records): (download) 
    >4oolA (A:)
vrhiaipahrglitdrngeplavstpvttlwanpkelmtakerwpqlaaalgqdtklfad
rieqnaerefiylvrgltpeqgegvialkvpgvysieefrrfypagevvahavgftdvdd
rgregielafdewlagvpgkrqvlkdrrgrvikdvqvtknakpgktlalsidlrlqylah
relrnallengakagslvimdvktgeilamtnqptynpnnrrnlqpaamrnramidvfep
gstvkpfsmsaalasgrwkpsdivdvypgtlqigrytirdvsrnsrqldltgilikssnv
giskiafdigaesiysvmqqvglgqdtglgfpgervgnlpnhrkwpkaetatlaygygls
vtaiqlahayaalandgksvplsmtrvdrvpdgvqvispevastvqgmlqqvveaqggvf
raqvpgyhaagksgtarknayrslfagfapatdpriamvvvidepskagyfgglvsapvf
skvmagalrlmnvppdnlp