4rns: Difference between revisions

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</td></tr><tr id='resources'><td class="sblockLbl"><b>Resources:</b></td><td class="sblockDat"><span class='plainlinks'>[http://oca.weizmann.ac.il/oca-docs/fgij/fg.htm?mol=4rns FirstGlance], [http://oca.weizmann.ac.il/oca-bin/ocaids?id=4rns OCA], [http://www.rcsb.org/pdb/explore.do?structureId=4rns RCSB], [http://www.ebi.ac.uk/pdbsum/4rns PDBsum]</span></td></tr>
</td></tr><tr id='resources'><td class="sblockLbl"><b>Resources:</b></td><td class="sblockDat"><span class='plainlinks'>[http://oca.weizmann.ac.il/oca-docs/fgij/fg.htm?mol=4rns FirstGlance], [http://oca.weizmann.ac.il/oca-bin/ocaids?id=4rns OCA], [http://www.rcsb.org/pdb/explore.do?structureId=4rns RCSB], [http://www.ebi.ac.uk/pdbsum/4rns PDBsum]</span></td></tr>
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</table>
== Function ==
[[http://www.uniprot.org/uniprot/PCPR_SPHCR PCPR_SPHCR]] Transcriptional activator for the pcpA, pcpB and pcpE genes for pentachlorophenol (PCP) degradation. Essential for PCP degradation.<ref>PMID:12169590</ref> 
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== Publication Abstract from PubMed ==
== Publication Abstract from PubMed ==

Revision as of 22:32, 24 December 2014

PcpR inducer binding domain (apo-form)PcpR inducer binding domain (apo-form)

Structural highlights

4rns is a 4 chain structure. Full crystallographic information is available from OCA. For a guided tour on the structure components use FirstGlance.
Resources:FirstGlance, OCA, RCSB, PDBsum

Function

[PCPR_SPHCR] Transcriptional activator for the pcpA, pcpB and pcpE genes for pentachlorophenol (PCP) degradation. Essential for PCP degradation.[1]

Publication Abstract from PubMed

PcpR is a LysR-type transcription factor from Sphingobium chlorophenolicum L-1 that is responsible for the activation of several genes involved in polychlorophenol degradation. PcpR responds to several polychlorophenols in vivo. Here, we report the crystal structures of the inducer-binding domain of PcpR in the apo-form and binary complexes with pentachlorophenol (PCP) and 2,4,6-trichlorophenol (2,4,6-TCP). Both X-ray crystal structures and isothermal titration calorimetry data indicated the association of two PCP molecules per PcpR, but only one 2,4,6-TCP molecule. The hydrophobic nature and hydrogen bonds of one binding cavity allowed the tight association of both PCP (Kd = 110 nM) and 2,4,6-TCP (Kd = 22.8 nM). However, the other cavity was unique to PCP with much weaker affinity (Kd = 70 muM) and thus its significance was not clear. Neither phenol nor benzoic acid displayed any significant affinity to PcpR, indicating a role of chlorine substitution in ligand specificity. When PcpR is compared with TcpR, a LysR-type regulator controlling the expression of 2,4,6-trichlorophenol degradation in Cupriavidus necator JMP134, most of the residues constituting the two inducer-binding cavities of PcpR are different, except for their general hydrophobic nature. The finding concurs that PcpR uses various polychlorophenols as long as it includes 2,4,6-trichlorophenol, as inducers; whereas TcpR is only responsive to 2,4,6-trichlorophenol.

Structures of the Inducer-Binding Domain of Pentachlorophenol-Degrading Gene Regulator PcpR from Sphingobium chlorophenolicum.,Hayes RP, Moural TW, Lewis KM, Onofrei D, Xun L, Kang C Int J Mol Sci. 2014 Nov 12;15(11):20736-52. doi: 10.3390/ijms151120736. PMID:25397598[2]

From MEDLINE®/PubMed®, a database of the U.S. National Library of Medicine.

References

  1. Cai M, Xun L. Organization and regulation of pentachlorophenol-degrading genes in Sphingobium chlorophenolicum ATCC 39723. J Bacteriol. 2002 Sep;184(17):4672-80. PMID:12169590
  2. Hayes RP, Moural TW, Lewis KM, Onofrei D, Xun L, Kang C. Structures of the Inducer-Binding Domain of Pentachlorophenol-Degrading Gene Regulator PcpR from Sphingobium chlorophenolicum. Int J Mol Sci. 2014 Nov 12;15(11):20736-52. doi: 10.3390/ijms151120736. PMID:25397598 doi:http://dx.doi.org/10.3390/ijms151120736

4rns, resolution 2.70Å

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OCA